Structures by: Li X.

Total: 2 684

C14H11N5

C14H11N5

Li, chenGe, HaixiaYin, BingShe, MengyaoLiu, PingLi, XiangdongLi, Jianli

RSC Adv. (2015)

a=11.781(4)Å   b=8.473(3)Å   c=24.554(9)Å

α=90.00°   β=91.214(6)°   γ=90.00°

C59H80FeO2P4

C59H80FeO2P4

huang, shaofengzhao, huaLi, Xiaoyanwang, linSun, Hongjian

RSC Adv. (2015)

a=21.067(4)Å   b=12.873(3)Å   c=22.808(5)Å

α=90.00°   β=115.18(3)°   γ=90.00°

C59H79CoO2P4

C59H79CoO2P4

huang, shaofengzhao, huaLi, Xiaoyanwang, linSun, Hongjian

RSC Adv. (2015)

a=12.4365(16)Å   b=13.4615(19)Å   c=19.727(3)Å

α=94.511(3)°   β=104.832(2)°   γ=91.585(3)°

C56H70FeIO2P3

C56H70FeIO2P3

huang, shaofengzhao, huaLi, Xiaoyanwang, linSun, Hongjian

RSC Adv. (2015)

a=16.196(3)Å   b=12.997(3)Å   c=30.608(6)Å

α=90.00°   β=97.19(3)°   γ=90.00°

C59H80NiO2P4

C59H80NiO2P4

huang, shaofengzhao, huaLi, Xiaoyanwang, linSun, Hongjian

RSC Adv. (2015)

a=14.2600(5)Å   b=14.5978(6)Å   c=15.3049(7)Å

α=96.364(3)°   β=92.785(3)°   γ=118.212(3)°

C37.5H38DyF18N5O10

C37.5H38DyF18N5O10

Tian, LiZhou, Shang YongLi, XinLi, TingLiu, Zhong YiWang, Xiuguang

RSC Adv. (2015)

a=12.223(2)Å   b=12.935(3)Å   c=31.349(6)Å

α=89.49(3)°   β=80.03(3)°   γ=75.48(3)°

C37.5H38F18N5O10Tb

C37.5H38F18N5O10Tb

Tian, LiZhou, Shang YongLi, XinLi, TingLiu, Zhong YiWang, Xiuguang

RSC Adv. (2015)

a=12.261(3)Å   b=12.857(3)Å   c=31.381(6)Å

α=89.34(3)°   β=80.44(3)°   γ=75.18(3)°

C75H76F36N10Nd2O20

C75H76F36N10Nd2O20

Tian, LiZhou, Shang YongLi, XinLi, TingLiu, Zhong YiWang, Xiuguang

RSC Adv. (2015)

a=12.3461(17)Å   b=12.9126(18)Å   c=31.521(4)Å

α=89.120(3)°   β=80.018(3)°   γ=75.287(3)°

C75H76F36N10O20Sm2

C75H76F36N10O20Sm2

Tian, LiZhou, Shang YongLi, XinLi, TingLiu, Zhong YiWang, Xiuguang

RSC Adv. (2015)

a=12.2813(15)Å   b=12.8859(16)Å   c=31.337(4)Å

α=89.214(2)°   β=80.045(2)°   γ=75.205(2)°

C72H69ClF36Gd2N10O20

C72H69ClF36Gd2N10O20

Tian, LiZhou, Shang YongLi, XinLi, TingLiu, Zhong YiWang, Xiuguang

RSC Adv. (2015)

a=12.2289(18)Å   b=13.0026(19)Å   c=31.399(5)Å

α=91.003(4)°   β=101.201(3)°   γ=104.313(3)°

C71.5H68F36N10O20Pr2

C71.5H68F36N10O20Pr2

Tian, LiZhou, Shang YongLi, XinLi, TingLiu, Zhong YiWang, Xiuguang

RSC Adv. (2015)

a=12.3277(12)Å   b=12.8508(12)Å   c=31.587(3)Å

α=88.786(2)°   β=80.416(2)°   γ=75.270(2)°

C34H21N5O14S2Sm2

C34H21N5O14S2Sm2

Zhang, Yi-HuaLi, XiaSong, ShuangYang, Hong-YuMa, DouLiu, Yi-Heng

CrystEngComm (2014) 16, 36 8390

a=9.6304(7)Å   b=9.6386(7)Å   c=10.0130(7)Å

α=85.4430(10)°   β=72.7850(10)°   γ=72.7610(10)°

C31H21GdN5O8S2

C31H21GdN5O8S2

Zhang, Yi-HuaLi, XiaSong, ShuangYang, Hong-YuMa, DouLiu, Yi-Heng

CrystEngComm (2014) 16, 36 8390

a=10.5440(14)Å   b=10.5785(15)Å   c=15.068(2)Å

α=92.469(3)°   β=110.420(2)°   γ=107.942(3)°

C31H21N5O8S2Tb

C31H21N5O8S2Tb

Zhang, Yi-HuaLi, XiaSong, ShuangYang, Hong-YuMa, DouLiu, Yi-Heng

CrystEngComm (2014) 16, 36 8390

a=10.5381(14)Å   b=10.5712(13)Å   c=15.041(2)Å

α=75.114(4)°   β=69.497(2)°   γ=72.006(2)°

C31H21ErN5O8S2

C31H21ErN5O8S2

Zhang, Yi-HuaLi, XiaSong, ShuangYang, Hong-YuMa, DouLiu, Yi-Heng

CrystEngComm (2014) 16, 36 8390

a=10.542(3)Å   b=10.561(3)Å   c=14.961(4)Å

α=75.527(6)°   β=69.711(6)°   γ=71.721(6)°

C31H21N5O8S2Yb

C31H21N5O8S2Yb

Zhang, Yi-HuaLi, XiaSong, ShuangYang, Hong-YuMa, DouLiu, Yi-Heng

CrystEngComm (2014) 16, 36 8390

a=10.5522(9)Å   b=10.5726(10)Å   c=14.9134(13)Å

α=75.774(2)°   β=69.8350(10)°   γ=71.5590(10)°

0.5(C80H56N12O4Zn2),0.35(CH4O)

0.5(C80H56N12O4Zn2),0.35(CH4O)

Zhang, LiyanSun, LiyingLi, XinyuanTian, YulanYuan, Guozan

Dalton transactions (Cambridge, England : 2003) (2015) 44, 1 401-410

a=12.9164(17)Å   b=10.2951(14)Å   c=14.240(2)Å

α=90°   β=113.820(3)°   γ=90°

C40H28N6O2Zn

C40H28N6O2Zn

Zhang, LiyanSun, LiyingLi, XinyuanTian, YulanYuan, Guozan

Dalton transactions (Cambridge, England : 2003) (2015) 44, 1 401-410

a=9.168(3)Å   b=17.701(7)Å   c=19.845(8)Å

α=90.00°   β=90.00°   γ=90.00°

C60H42Cd2N9O3

C60H42Cd2N9O3

Zhang, LiyanSun, LiyingLi, XinyuanTian, YulanYuan, Guozan

Dalton transactions (Cambridge, England : 2003) (2015) 44, 1 401-410

a=30.7574(16)Å   b=30.7574(16)Å   c=12.1006(12)Å

α=90°   β=90°   γ=120°

C23H40FeNOP3

C23H40FeNOP3

Zuo, ZhenyuSun, HongjianWang, LinLi, Xiaoyan

Dalton transactions (Cambridge, England : 2003) (2014) 43, 30 11716-11722

a=17.694(4)Å   b=9.5613(19)Å   c=33.263(7)Å

α=90.00°   β=91.29(3)°   γ=90.00°

C24H42FeNOP3

C24H42FeNOP3

Zuo, ZhenyuSun, HongjianWang, LinLi, Xiaoyan

Dalton transactions (Cambridge, England : 2003) (2014) 43, 30 11716-11722

a=36.1399(10)Å   b=9.5531(4)Å   c=17.9590(5)Å

α=90.00°   β=107.528(2)°   γ=90.00°

GaGe3NaSe8

GaGe3NaSe8

Li, XiaoshuangLi, ChaoGong, PifuLin, ZheshuaiYao, JiyongWu, Yicheng

Dalton transactions (Cambridge, England : 2003) (2015) 45, 2 532-538

a=7.2329(14)Å   b=11.889(2)Å   c=17.550(4)Å

α=90.00°   β=101.75(3)°   γ=90.00°

Ga3Ge7K3S20

Ga3Ge7K3S20

Li, XiaoshuangLi, ChaoGong, PifuLin, ZheshuaiYao, JiyongWu, Yicheng

Dalton transactions (Cambridge, England : 2003) (2015) 45, 2 532-538

a=6.7665(4)Å   b=37.527(2)Å   c=6.6796(4)Å

α=90.00°   β=90.802(5)°   γ=90.00°

C62H62Dy2N8O22

C62H62Dy2N8O22

Ke, HongshanZhang, ShengLi, XinWei, QingXie, GangWang, WenyuanChen, Sanping

Dalton transactions (Cambridge, England : 2003) (2015) 44, 48 21025-21031

a=13.432(2)Å   b=10.503(2)Å   c=24.428(4)Å

α=90.00°   β=98.478(4)°   γ=90.00°

C48H22F12N4O15Tb2

C48H22F12N4O15Tb2

Li, Jia-JiaFan, Ting-TingQu, Xiang-LongHan, Hong-LiangLi, Xia

Dalton transactions (Cambridge, England : 2003) (2016) 45, 7 2924-2935

a=13.9969(10)Å   b=14.1432(10)Å   c=14.9746(11)Å

α=63.8960(10)°   β=81.0240(10)°   γ=65.4650(10)°

C48H22F12N4O15Sm2

C48H22F12N4O15Sm2

Li, Jia-JiaFan, Ting-TingQu, Xiang-LongHan, Hong-LiangLi, Xia

Dalton transactions (Cambridge, England : 2003) (2016) 45, 7 2924-2935

a=13.9748(5)Å   b=14.1728(5)Å   c=15.0597(6)Å

α=63.6830(10)°   β=81.1270(10)°   γ=65.5600(10)°

C48H22Dy2F12N4O15

C48H22Dy2F12N4O15

Li, Jia-JiaFan, Ting-TingQu, Xiang-LongHan, Hong-LiangLi, Xia

Dalton transactions (Cambridge, England : 2003) (2016) 45, 7 2924-2935

a=14.0352(6)Å   b=14.0913(6)Å   c=14.8999(6)Å

α=64.1260(10)°   β=80.6990(10)°   γ=65.5260(10)°

C75H31F20N6O21Tb3

C75H31F20N6O21Tb3

Li, Jia-JiaFan, Ting-TingQu, Xiang-LongHan, Hong-LiangLi, Xia

Dalton transactions (Cambridge, England : 2003) (2016) 45, 7 2924-2935

a=14.8112(5)Å   b=15.1466(6)Å   c=17.7503(6)Å

α=94.0300(10)°   β=106.6950(10)°   γ=106.0090(10)°

C48H22F12Gd2N4O15

C48H22F12Gd2N4O15

Li, Jia-JiaFan, Ting-TingQu, Xiang-LongHan, Hong-LiangLi, Xia

Dalton transactions (Cambridge, England : 2003) (2016) 45, 7 2924-2935

a=13.9713(6)Å   b=14.1629(6)Å   c=15.0301(6)Å

α=63.6820(10)°   β=81.1340(10)°   γ=65.4950(10)°

C75H31Dy3F20N6O21

C75H31Dy3F20N6O21

Li, Jia-JiaFan, Ting-TingQu, Xiang-LongHan, Hong-LiangLi, Xia

Dalton transactions (Cambridge, England : 2003) (2016) 45, 7 2924-2935

a=14.9487(8)Å   b=15.1983(8)Å   c=17.8426(9)Å

α=93.9610(10)°   β=106.5750(10)°   γ=106.2460(10)°

C75H31F20N6O21Yb3

C75H31F20N6O21Yb3

Li, Jia-JiaFan, Ting-TingQu, Xiang-LongHan, Hong-LiangLi, Xia

Dalton transactions (Cambridge, England : 2003) (2016) 45, 7 2924-2935

a=14.9051(8)Å   b=15.1445(8)Å   c=17.7458(9)Å

α=94.0730(10)°   β=106.6590(10)°   γ=106.2680(10)°

C66H22Eu2F24N4O12

C66H22Eu2F24N4O12

Li, Jia-JiaFan, Ting-TingQu, Xiang-LongHan, Hong-LiangLi, Xia

Dalton transactions (Cambridge, England : 2003) (2016) 45, 7 2924-2935

a=13.7343(11)Å   b=25.573(2)Å   c=19.4155(16)Å

α=90°   β=108.900(2)°   γ=90°

C66H22F24N4O12Tb2

C66H22F24N4O12Tb2

Li, Jia-JiaFan, Ting-TingQu, Xiang-LongHan, Hong-LiangLi, Xia

Dalton transactions (Cambridge, England : 2003) (2016) 45, 7 2924-2935

a=13.7029(11)Å   b=25.668(2)Å   c=19.3097(15)Å

α=90°   β=108.738(2)°   γ=90°

C48H22Eu2F12N4O15

C48H22Eu2F12N4O15

Li, Jia-JiaFan, Ting-TingQu, Xiang-LongHan, Hong-LiangLi, Xia

Dalton transactions (Cambridge, England : 2003) (2016) 45, 7 2924-2935

a=13.965(3)Å   b=14.161(3)Å   c=15.035(3)Å

α=63.69(3)°   β=81.15(3)°   γ=65.52(3)°

Sc3N@D5h-C80-W(CO)3(dppe)

C109H24NO3P2Sc3W,CS2

Bao, LipiaoLiu, BinLi, XiaofangPan, ChangwangXie, YunpengLu, Xing

Dalton transactions (Cambridge, England : 2003) (2016) 45, 29 11606-11610

a=11.2765(5)Å   b=13.9075(6)Å   c=20.3011(9)Å

α=90.5360(10)°   β=98.0780(10)°   γ=97.157(2)°

Sc3N@Ih-C80-W(CO)3(dppe)

C109H24NO3P2Sc3W,CS2

Bao, LipiaoLiu, BinLi, XiaofangPan, ChangwangXie, YunpengLu, Xing

Dalton transactions (Cambridge, England : 2003) (2016) 45, 29 11606-11610

a=11.24500(10)Å   b=20.4936(2)Å   c=27.7203(3)Å

α=90°   β=96.03°   γ=90°

C43H34Cl4F12N8O2P2Ru2

C43H34Cl4F12N8O2P2Ru2

Su, XianlongZeng, RongqingLi, XianghongDang, WeijieYao, KaiyueTang, Dingguo

Dalton transactions (Cambridge, England : 2003) (2016) 45, 17 7450-7459

a=12.2899(5)Å   b=16.2558(6)Å   c=13.4995(5)Å

α=90.00°   β=114.6440(10)°   γ=90.00°

C36H28Cd2N6O8

C36H28Cd2N6O8

Qu, Xiang-LongGui, DiZheng, Xiao-LiLi, RuiHan, Hong-LiangLi, XiaLi, Pei-Zhou

Dalton transactions (Cambridge, England : 2003) (2016) 45, 16 6983-6989

a=11.823(2)Å   b=11.823(2)Å   c=41.384(8)Å

α=90.00°   β=90.00°   γ=120.00°

C23H50Al2LuNSi

C23H50Al2LuNSi

Shi, LiqinSu, QiChen, JueLi, XiaonianLuo, Yunjie

Dalton transactions (Cambridge, England : 2003) (2016) 45, 4 1391-1397

a=15.073(3)Å   b=12.4138(19)Å   c=17.680(3)Å

α=90.00°   β=112.964(3)°   γ=90.00°

C34H36AuP

C34H36AuP

Zhang, RuiZhao, ChongyangLi, XiuminZhang, ZongyaoAi, XichengChen, HuiCao, Rui

Dalton transactions (Cambridge, England : 2003) (2016) 45, 32 12772-12778

a=9.2356(6)Å   b=12.7366(8)Å   c=28.0258(19)Å

α=80.454(2)°   β=83.007(2)°   γ=69.185(2)°

C257H338Ag8Au8Cl2

C257H338Ag8Au8Cl2

Zhang, RuiZhao, ChongyangLi, XiuminZhang, ZongyaoAi, XichengChen, HuiCao, Rui

Dalton transactions (Cambridge, England : 2003) (2016) 45, 32 12772-12778

a=20.761(4)Å   b=39.030(8)Å   c=32.261(7)Å

α=90°   β=92.37(3)°   γ=90°

C6H24CoF11N6Ti2

C6H24CoF11N6Ti2

Du, YuYu, JihongHong, XuemingLi, XuejinTian, Xiaoqing

Dalton transactions (Cambridge, England : 2003) (2014) 43, 37 14039-14044

a=7.9858(16)Å   b=8.3733(17)Å   c=14.325(3)Å

α=93.98(3)°   β=96.26(3)°   γ=113.76(3)°

C18H59ClCoF6N6O3.5P0Si0Zr

C18H59ClCoF6N6O3.5P0Si0Zr

Du, YuYu, JihongHong, XuemingLi, XuejinTian, Xiaoqing

Dalton transactions (Cambridge, England : 2003) (2014) 43, 37 14039-14044

a=21.592(4)Å   b=13.944(3)Å   c=18.920(4)Å

α=90.00°   β=99.21(3)°   γ=90.00°

K2Se6Sn2Zn

K2Se6Sn2Zn

Zhou, MolinLi, ChaoLi, XiaoshuangYao, JiyongWu, Yicheng

Dalton transactions (Cambridge, England : 2003) (2016) 45, 18 7627-7633

a=8.1511(12)Å   b=8.1511(12)Å   c=19.570(4)Å

α=90.00°   β=90.00°   γ=90.00°

Ge2Na2Se6Zn

Ge2Na2Se6Zn

Zhou, MolinLi, ChaoLi, XiaoshuangYao, JiyongWu, Yicheng

Dalton transactions (Cambridge, England : 2003) (2016) 45, 18 7627-7633

a=7.7568(12)Å   b=7.7568(12)Å   c=18.734(4)Å

α=90.00°   β=90.00°   γ=90.00°

GeIn2Na2Se6

GeIn2Na2Se6

Zhou, MolinLi, ChaoLi, XiaoshuangYao, JiyongWu, Yicheng

Dalton transactions (Cambridge, England : 2003) (2016) 45, 18 7627-7633

a=12.707(3)Å   b=8.1157(16)Å   c=12.760(3)Å

α=90.00°   β=108.70(3)°   γ=90.00°

C6H24CoF11N6Ti2

C6H24CoF11N6Ti2

Du, YuYu, JihongHong, XuemingLi, XuejinTian, Xiaoqing

Dalton transactions (Cambridge, England : 2003) (2014) 43, 37 14039-14044

a=7.9858(16)Å   b=8.3733(17)Å   c=14.325(3)Å

α=93.98(3)°   β=96.26(3)°   γ=113.76(3)°

C18H59ClCoF6N6O3.5P0Si0Zr

C18H59ClCoF6N6O3.5P0Si0Zr

Du, YuYu, JihongHong, XuemingLi, XuejinTian, Xiaoqing

Dalton transactions (Cambridge, England : 2003) (2014) 43, 37 14039-14044

a=21.592(4)Å   b=13.944(3)Å   c=18.920(4)Å

α=90.00°   β=99.21(3)°   γ=90.00°

C20H23BrN4Ni

C20H23BrN4Ni

Sun, YunqiangLi, XiaoyanSun, Hongjian

Dalton transactions (Cambridge, England : 2003) (2014) 43, 25 9410-9413

a=19.216(6)Å   b=10.729(4)Å   c=9.506(3)Å

α=90.00°   β=90.00°   γ=90.00°

C200H136N20O4Zn4

C200H136N20O4Zn4

Fang, XianshiHan, ZhenXu, ChenglongLi, XiaohongWang, YongHu, Chuanjiang

Dalton transactions (Cambridge, England : 2003) (2015) 44, 28 12511-12515

a=31.160(3)Å   b=19.409(2)Å   c=32.877(4)Å

α=90.00°   β=103.566(2)°   γ=90.00°

C97H62Cu2N10O2

C97H62Cu2N10O2

Fang, XianshiHan, ZhenXu, ChenglongLi, XiaohongWang, YongHu, Chuanjiang

Dalton transactions (Cambridge, England : 2003) (2015) 44, 28 12511-12515

a=17.8413(2)Å   b=17.8413(2)Å   c=27.0941(5)Å

α=90.00°   β=90.00°   γ=90.00°

C27H62LuN3OSi5

C27H62LuN3OSi5

Shi, LiqinSu, QiChen, JueLi, XiaonianLuo, Yunjie

Dalton transactions (Cambridge, England : 2003) (2016) 45, 4 1391-1397

a=10.90040(17)Å   b=17.2340(2)Å   c=21.1886(3)Å

α=90.00°   β=102.4275(15)°   γ=90.00°

C23H50Al2NSiY

C23H50Al2NSiY

Shi, LiqinSu, QiChen, JueLi, XiaonianLuo, Yunjie

Dalton transactions (Cambridge, England : 2003) (2016) 45, 4 1391-1397

a=14.709(4)Å   b=12.437(3)Å   c=17.541(5)Å

α=90.00°   β=112.473(7)°   γ=90.00°

C80NU2,C36H44N4Ni,CS2,3(C3H3)

C80NU2,C36H44N4Ni,CS2,3(C3H3)

Li, XiaomengRoselló, YannickYao, Yang-RongZhuang, JiaxinZhang, XingxingRodríguez-Fortea, Antoniode Graaf, CoenEchegoyen, LuisPoblet, Josep M.Chen, Ning

Chemical Science (2021) 12, 1 282-292

a=17.6663(2)Å   b=16.9578(2)Å   c=26.7308(3)Å

α=90°   β=106.76°   γ=90°

0.5(I20Pb6),C2H12N2,C8H22I2N2

0.5(I20Pb6),C2H12N2,C8H22I2N2

Li, DongWu, WentaoLiu, XitaoHan, ShiguoPeng, Yuli, xiaoqiLi, LinaHong, MaochunLuo, Junhua

Chemical Science (2021)

a=8.909(2)Å   b=9.012(3)Å   c=27.896(8)Å

α=90°   β=92.832(10)°   γ=90°

I10Pb3,2(C4H11IN),2(CH6N)

I10Pb3,2(C4H11IN),2(CH6N)

Li, DongWu, WentaoLiu, XitaoHan, ShiguoPeng, Yuli, xiaoqiLi, LinaHong, MaochunLuo, Junhua

Chemical Science (2021)

a=27.3848(12)Å   b=9.0015(4)Å   c=8.8216(3)Å

α=90°   β=95.9990(10)°   γ=90°

C68H68Cl2N4O4S2

C68H68Cl2N4O4S2

Li, XiaojunAngunawela, IndunilChang, YuanZhou, JiadongHuang, HeZhong, LianLiebman-Pelaez, AlexZhu, ChenhuiMeng, LeiXie, ZengqiAde, HaraldYan, HeLi, Yongfang

Energy & Environmental Science (2020) 13, 12 5028-5038

a=13.3351(4)Å   b=16.6987(4)Å   c=17.3392(3)Å

α=88.307(2)°   β=76.712(2)°   γ=82.866(2)°

C82H88Cl2N8O2S5

C82H88Cl2N8O2S5

Li, XiaojunAngunawela, IndunilChang, YuanZhou, JiadongHuang, HeZhong, LianLiebman-Pelaez, AlexZhu, ChenhuiMeng, LeiXie, ZengqiAde, HaraldYan, HeLi, Yongfang

Energy & Environmental Science (2020) 13, 12 5028-5038

a=13.6375(6)Å   b=15.3980(5)Å   c=19.4824(6)Å

α=105.241(3)°   β=94.313(4)°   γ=99.330(3)°

C82H88Cl2N8O2S5

C82H88Cl2N8O2S5

Li, XiaojunAngunawela, IndunilChang, YuanZhou, JiadongHuang, HeZhong, LianLiebman-Pelaez, AlexZhu, ChenhuiMeng, LeiXie, ZengqiAde, HaraldYan, HeLi, Yongfang

Energy & Environmental Science (2020) 13, 12 5028-5038

a=14.699(2)Å   b=17.173(3)Å   c=17.727(2)Å

α=65.789(14)°   β=65.996(13)°   γ=72.836(14)°

2(C34H34ClN2O2S)

2(C34H34ClN2O2S)

Li, XiaojunAngunawela, IndunilChang, YuanZhou, JiadongHuang, HeZhong, LianLiebman-Pelaez, AlexZhu, ChenhuiMeng, LeiXie, ZengqiAde, HaraldYan, HeLi, Yongfang

Energy & Environmental Science (2020) 13, 12 5028-5038

a=14.6444(12)Å   b=15.9434(16)Å   c=17.9860(11)Å

α=106.356(7)°   β=113.691(7)°   γ=95.799(8)°

C14H12ClN

C14H12ClN

Sun, XingxingZhang, BaichengLi, XinyangTrindle, Carl O.Zhang, Guoqing

The journal of physical chemistry. A (2016) 120, 29 5791-5797

a=5.3267(7)Å   b=12.3539(16)Å   c=17.375(3)Å

α=90°   β=95.587(12)°   γ=90°

C12H11BrF3N

C12H11BrF3N

Sun, XingxingZhang, BaichengLi, XinyangTrindle, Carl O.Zhang, Guoqing

The journal of physical chemistry. A (2016) 120, 29 5791-5797

a=7.7226(5)Å   b=15.4950(9)Å   c=10.3948(6)Å

α=90°   β=97.226(5)°   γ=90°

C39H42BNO

C39H42BNO

Shi, Yong-GangWang, Jun-WeiLi, HaijunHu, Guo-FeiLi, XueMellerup, Soren K.Wang, NanPeng, TaiWang, Suning

Chemical science (2018) 9, 7 1902-1911

a=38.4003(15)Å   b=9.7146(4)Å   c=18.3058(8)Å

α=90°   β=114.338(2)°   γ=90°

C24H31AlN2

C24H31AlN2

Yu, ChaoZhang, PengfeiGao, FeiZhang, ShaowenLi, Xiaofang

Polymer Chemistry (2018) 9, 5 603

a=7.0719(14)Å   b=11.897(2)Å   c=15.148(3)Å

α=76.92(3)°   β=86.12(3)°   γ=85.20(3)°

C25H27BO

C25H27BO

Shi, Yong-GangWang, Jun-WeiLi, HaijunHu, Guo-FeiLi, XueMellerup, Soren K.Wang, NanPeng, TaiWang, Suning

Chemical science (2018) 9, 7 1902-1911

a=8.4880(6)Å   b=10.8609(7)Å   c=12.4693(9)Å

α=97.707(2)°   β=98.593(2)°   γ=105.796(2)°

3

C26H49LuO3Si2

Yan, XinwenZhang, ShaowenPeng, DeqianZhang, PengfeiZhi, JungeWu, XiaoluWang, LinDong, YupingLi, Xiaofang

Polymer Chemistry (2018) 9, 8 984

a=8.2286(16)Å   b=17.857(4)Å   c=10.889(2)Å

α=90°   β=109.76(3)°   γ=90°

C24H18F3NO3S

C24H18F3NO3S

Liu, BingxianHu, PanjieZhang, YingLi, YunyunBai, DachangLi, Xingwei

Organic letters (2017) 19, 19 5402-5405

a=11.3446(4)Å   b=15.1444(5)Å   c=13.1535(4)Å

α=90°   β=104.430(3)°   γ=90°

C14H28B20N2

C14H28B20N2

Yan, HongLi, XiangYin, YonghengLu, ChangshengTong, XiaoZhao, Qiang

Chem. Sci. (2017)

a=30.853(15)Å   b=6.836(3)Å   c=12.622(6)Å

α=90.00°   β=106.229(9)°   γ=90.00°

Cyclo[6]aramide/Paraquat complex

C84H114N6O18,0.5(C12H14N2),F6P

Li, XiaoweiYuan, XiangyangDeng, PengchiChen, LixiRen, YiWang, ChengyuanWu, LixinFeng, WenGong, BingYuan, Lihua

Chemical science (2017) 8, 3 2091-2100

a=22.630(8)Å   b=23.529(9)Å   c=19.425(7)Å

α=90.00°   β=112.979(5)°   γ=90.00°

C66H85Ag3ClN18O6,C4H8O2,2(F6P),CHCl3

C66H85Ag3ClN18O6,C4H8O2,2(F6P),CHCl3

Wei, SipingLi, XiyuYang, ZhuangLan, JingboGao, GeXue, YingYou, Jingsong

Chemical Science (2012) 3, 2 359

a=12.6553(3)Å   b=13.0092(5)Å   c=15.1663(4)Å

α=104.239(3)°   β=112.900(3)°   γ=99.765(3)°

C29H20N2

C29H20N2

Chen, JinleiSong, GuoyongPan, Cheng-LingLi, Xingwei

Organic letters (2010) 12, 23 5426-5429

a=21.7125(10)Å   b=20.0272(10)Å   c=9.6399(4)Å

α=90.00°   β=95.9050(10)°   γ=90.00°

Pallambin D

C19H22O4

Wang, Li-NingZhang, Jiao-ZhenLi, XiaWang, Xiao-NingXie, Chun-FengZhou, Jin-ChuanLou, Hong-Xiang

Organic letters (2012) 14, 4 1102-1105

a=8.1441(6)Å   b=28.387(2)Å   c=7.2652(6)Å

α=90.00°   β=90.00°   γ=90.00°

Tinidazole--vanillic acid (1/1)

C8H13N3O4S,C8H8O4

Zheng, KangXie, ChangjianLi, XiaoweiWu, WeiweiLi, AoQian, ShaosongPang, Qiuxiang

Acta Crystallographica Section C (2020) 76, 5

a=11.1206(5)Å   b=12.6519(6)Å   c=13.6042(6)Å

α=98.0780(10)°   β=97.7930(10)°   γ=99.7800(10)°

Poly[hexakis[μ~4~-(2-carboxylatophenyl)sulfanido]di-μ~3~-chlorido-tri-μ~2~-hydroxido-octanickel(II)sodium(I)]

C42H27Cl2NaNi8O15S6

Zhu, JingyanYan, ShanXiao, HongpingJiang, JunLi, Xinhua

Acta Crystallographica Section C (2019) 75, 7

a=13.2027(7)Å   b=13.2027(7)Å   c=18.3116(12)Å

α=90°   β=90°   γ=120°

[K(222)][Fe(TpivPP)Cl](C6H14)

C18H36KN2O6,C64H64ClFeN8O4,C6H14

Yu, QiangLiu, DianshengLi, XiangjunLi, Jianfeng

Acta Crystallographica Section C (2015) 71, 10

a=13.0174(4)Å   b=14.3273(8)Å   c=24.1557(13)Å

α=80.946(4)°   β=79.029(4)°   γ=87.039(3)°

C13H22N2O5

C13H22N2O5

Li, ZihanYang, PengpengLiu, HaodongLiu, JunZhu, ShaLi, XiaojieZhuang, WeiWu, JinglanYing, Hanjie

Acta Crystallographica Section B (2020) 76, 4

a=9.8441(8)Å   b=10.8561(9)Å   c=13.5205(12)Å

α=90°   β=96.728(2)°   γ=90°

C13H20N2O4

C13H20N2O4

Li, ZihanYang, PengpengLiu, HaodongLiu, JunZhu, ShaLi, XiaojieZhuang, WeiWu, JinglanYing, Hanjie

Acta Crystallographica Section B (2020) 76, 4

a=8.2881(9)Å   b=9.5302(8)Å   c=10.6708(11)Å

α=113.460(4)°   β=105.990(3)°   γ=99.162(2)°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=7.82300Å   b=27.63680Å   c=9.81060Å

α=90°   β=112.5420°   γ=90°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=4.63220Å   b=24.67230Å   c=17.21010Å

α=90°   β=93.0760°   γ=90°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=4.56940Å   b=15.65760Å   c=27.82230Å

α=90°   β=90.4230°   γ=90°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=4.65230Å   b=12.32380Å   c=17.69700Å

α=78.4220°   β=88.0490°   γ=88.8470°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=7.82000Å   b=9.72850Å   c=14.28520Å

α=78.4470°   β=80.4540°   γ=67.4560°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=8.04390Å   b=12.08700Å   c=12.15390Å

α=61.2560°   β=88.4070°   γ=75.9430°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=7.89360Å   b=34.84550Å   c=7.57860Å

α=90°   β=106.0490°   γ=90°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=4.62400Å   b=29.71420Å   c=14.49510Å

α=90°   β=92.5910°   γ=90°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=7.25000Å   b=10.20820Å   c=14.66770Å

α=83.6220°   β=76.1990°   γ=73.8000°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=4.66110Å   b=12.45650Å   c=34.39970Å

α=90°   β=91.1110°   γ=90°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=17.61590Å   b=4.63220Å   c=25.06180Å

α=90°   β=97.8320°   γ=90°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=7.20920Å   b=8.21010Å   c=18.66430Å

α=87.4140°   β=84.7600°   γ=65.0430°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=12.25430Å   b=4.79740Å   c=33.90040Å

α=90°   β=95.5990°   γ=90°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=8.64470Å   b=10.70670Å   c=11.71540Å

α=87.4790°   β=83.4930°   γ=68.3760°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=7.48330Å   b=10.48670Å   c=13.67510Å

α=78.0920°   β=83.3590°   γ=70.7920°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=12.90230Å   b=10.90870Å   c=16.54040Å

α=90°   β=121.4760°   γ=90°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=8.63300Å   b=10.72270Å   c=10.98920Å

α=91.8750°   β=99.6550°   γ=90.7700°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=19.68880Å   b=4.64040Å   c=25.15110Å

α=90°   β=119.7400°   γ=90°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=6.94410Å   b=8.73160Å   c=17.98040Å

α=89.4770°   β=82.9770°   γ=68.1410°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=6.98490Å   b=9.14300Å   c=16.00910Å

α=86.3950°   β=83.1640°   γ=78.7810°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=19.59490Å   b=9.78610Å   c=10.60880Å

α=90°   β=92.5880°   γ=90°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=14.64800Å   b=9.37790Å   c=17.03990Å

α=90°   β=120.2790°   γ=90°

C21H17Cl2NO2

C21H17Cl2NO2

Reilly, Anthony M.Cooper, Richard I.Adjiman, Claire S.Bhattacharya, SaswataBoese, A. DanielBrandenburg, Jan GeritBygrave, Peter J.Bylsma, RitaCampbell, Josh E.Car, RobertoCase, David H.Chadha, RenuCole, Jason C.Cosburn, KatherineCuppen, Herma M.Curtis, FarrenDay, Graeme M.DiStasio Jr, Robert A.Dzyabchenko, Alexandervan Eijck, Bouke P.Elking, Dennis M.van den Ende, Joost A.Facelli, Julio C.Ferraro, Marta B.Fusti-Molnar, LaszloGatsiou, Christina-AnnaGee, Thomas S.de Gelder, RenéGhiringhelli, Luca M.Goto, HitoshiGrimme, StefanGuo, RuiHofmann, Detlef W. M.Hoja, JohannesHylton, Rebecca K.Iuzzolino, LucaJankiewicz, Wojciechde Jong, Daniël T.Kendrick, Johnde Klerk, Niek J. J.Ko, Hsin-YuKuleshova, Liudmila N.Li, XiayueLohani, SanjayaLeusen, Frank J. J.Lund, Albert M.Lv, JianMa, YanmingMarom, NoaMasunov, Artëm E.McCabe, PatrickMcMahon, David P.Meekes, HugoMetz, Michael P.Misquitta, Alston J.Mohamed, SharmarkeMonserrat, BartomeuNeeds, Richard J.Neumann, Marcus A.Nyman, JonasObata, ShigeakiOberhofer, HaraldOganov, Artem R.Orendt, Anita M.Pagola, Gabriel I.Pantelides, Constantinos C.Pickard, Chris J.Podeszwa, RafalPrice, Louise S.Price, Sarah L.Pulido, AngelesRead, Murray G.Reuter, KarstenSchneider, EliaSchober, ChristophShields, Gregory P.Singh, PawanpreetSugden, Isaac J.Szalewicz, KrzysztofTaylor, Christopher R.Tkatchenko, AlexandreTuckerman, Mark E.Vacarro, FrancescaVasileiadis, ManolisVazquez-Mayagoitia, AlvaroVogt, LeslieWang, YanchaoWatson, Rona E.de Wijs, Gilles A.Yang, JackZhu, QiangGroom, Colin R.

Acta Crystallographica Section B (2016) 72, 4 439-459

a=7.71050Å   b=27.84830Å   c=9.94800Å

α=90°   β=112.9390°   γ=90°