Structures by: McMahon J. A.
Total: 59
3-(4-dibenzo[b,f][1,4]oxepin-11-yl-piperazin-1-yl)-2,2-dimethylpropanoic acid Hydrate A 1.95
C22H25N3O3,H3.90O1.95
Molecular pharmaceutics (2015) 12, 8 3069-3088
a=26.663(7)Å b=9.634(2)Å c=20.863(9)Å
α=90° β=128.322(6)° γ=90°
3-(4-dibenzo[b,f][1,4]oxepin-11-yl-piperazin-1-yl)-2,2-dimethylpropanoic acid Dihydrate
C22H25N3O3,2(H2O)
Molecular pharmaceutics (2015) 12, 8 3069-3088
a=13.212(2)Å b=9.1505(15)Å c=18.160(3)Å
α=90° β=105.195(11)° γ=90°
3-(4-dibenzo[b,f][1,4]oxepin-11-yl-piperazin-1-yl)-2,2-dimethylpropanoic acid Hydrate A 1.73
C22H25N3O3,H3.46O1.73
Molecular pharmaceutics (2015) 12, 8 3069-3088
a=26.498(3)Å b=9.6469(8)Å c=20.342(3)Å
α=90° β=128.706(4)° γ=90°
1:1 co-crystal of 2-oxo-1-pyrrolidinyl)acetamide and 2,5- dihydroxybenzoic acid'
C6H10N2O2,C7H6O4
Chemical Communications (2005) 36 4601-4603
a=27.896(3)Å b=5.1762(5)Å c=19.7879(18)Å
α=90.00° β=101.090(2)° γ=90.00°
1:1 Co-crystal of 2-Oxo-1-pyrrolidinyl)acetamide and 4- Hydroxybenzoic acid
C6H10N2O2,C7H6O3
Chemical Communications (2005) 36 4601-4603
a=14.780(3)Å b=5.5029(12)Å c=17.068(4)Å
α=90.00° β=109.557(4)° γ=90.00°
BHA
C11H16O2
Chemical communications (Cambridge, England) (2004) 3 278-279
a=6.3179(11)Å b=14.364(3)Å c=17.960(3)Å
α=74.636(3)° β=80.608(4)° γ=86.767(3)°
BHA
C11H16O2
Chemical communications (Cambridge, England) (2004) 3 278-279
a=24.2612(11)Å b=24.2612(11)Å c=9.3049(8)Å
α=90.00° β=90.00° γ=120.00°
3-(4-(benzo[d]isoxazole-3-yl)piperazin-1-yl)-2,2-dimethylpropanoic acid
C16H21N3O3
Crystal Growth & Design (2014) 14, 4 2056
a=14.0905(3)Å b=6.25060(10)Å c=17.0170(3)Å
α=90° β=91.3210(10)° γ=90°
3-(4-dibenzo[b,f][1,4]oxepin-11-yl-piperazin-1-yl)-2,2-dimethylpropanoic acid
C22H25N3O3
Crystal Growth & Design (2014) 14, 4 2056
a=9.3970(3)Å b=10.8925(3)Å c=11.0095(4)Å
α=65.728(2)° β=67.321(2)° γ=77.584(2)°
3-(4-dibenzo[b,f][1,4]oxepin-11-yl-piperazin-1-yl)-2,2-dimethylpropanoic acid
C22H25N3O3
Crystal Growth & Design (2014) 14, 4 2056
a=9.2754(4)Å b=10.0504(5)Å c=11.8580(6)Å
α=106.010(4)° β=108.236(3)° γ=99.895(3)°
1:1 Co-crystal of Aspirin and Carbamazepine
C15H12N2O,C9H8O4
Journal of the American Chemical Society (2005)
a=9.0317(18)Å b=11.364(2)Å c=11.424(2)Å
α=60.350(4)° β=85.599(4)° γ=84.724(4)°
Form-II of Aspirin
C9H8O4
Journal of the American Chemical Society (2005)
a=12.095(7)Å b=6.491(4)Å c=11.323(6)Å
α=90.00° β=111.509(9)° γ=90.00°
2,4-Dimethoxy-6-morpholin-4-yl-[1,3,5]triazine
C9H14N4O3
Journal of the American Chemical Society (2005)
a=10.258(2)Å b=9.2156(18)Å c=14.158(5)Å
α=90.00° β=125.930(20)° γ=90.00°
C44H40Br2N2O4
C44H40Br2N2O4
Journal of the American Chemical Society (2005)
a=19.3272(7)Å b=11.6860(5)Å c=16.0890(6)Å
α=90.00° β=92.6300(10)° γ=90.00°
4-(4,6-Dimethoxy-[1,3,5]triazin-2-yl)-morpholin-4-ium; tetrafluoro borate
C10H17N4O3,BF4
Journal of the American Chemical Society (2005)
a=6.59250(10)Å b=10.65520(10)Å c=21.2960(2)Å
α=90.00° β=90.00° γ=90.00°
TGF beta
C22H19N5O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=19.4305(17)Å b=11.3245(11)Å c=9.1511(9)Å
α=90° β=95.302(5)° γ=90°
C22H19N5O
C22H19N5O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=8.2116(11)Å b=11.5104(14)Å c=11.8746(18)Å
α=102.001(10)° β=105.368(11)° γ=102.349(9)°
C22H19N5O
C22H19N5O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=7.7119(14)Å b=8.9111(17)Å c=14.617(2)Å
α=81.906(13)° β=78.799(14)° γ=75.258(15)°
TGF beta
C22H19N5O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=8.2599(3)Å b=19.6072(14)Å c=12.6913(6)Å
α=90° β=116.545(2)° γ=90°
TGF beta
C22H19N5O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=8.134(2)Å b=12.620(4)Å c=18.059(3)Å
α=86.707(19)° β=100.094(15)° γ=83.303(19)°
TGF Beta
C22H19N5O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=8.5537(2)Å b=11.3718(4)Å c=11.5674(5)Å
α=65.784(3)° β=105.495(3)° γ=77.315(2)°
C22H19N5O
C22H19N5O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=18.9981(11)Å b=9.8532(6)Å c=21.8829(13)Å
α=90° β=113.219(3)° γ=90°
TGF beta
C22H19N5O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=11.3011(3)Å b=20.8473(5)Å c=8.10637(17)Å
α=90° β=98.879(2)° γ=90°
C22H19N5O
C22H19N5O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=27.938(4)Å b=8.0817(7)Å c=22.004(3)Å
α=90° β=133.55(3)° γ=90°
4-[2-(6-methylpyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]quinoline
C22H19N5O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=27.654(13)Å b=8.108(8)Å c=21.934(11)Å
α=90° β=133.41(8)° γ=90°
C22H19N5OCH4O
C22H19N5OCH4O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=8.0458(4)Å b=22.6024(10)Å c=11.2097(5)Å
α=90° β=106.274(2)° γ=90°
TGF Beta
C22H19N5OC2H6O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=8.0820(4)Å b=9.2580(4)Å c=15.5250(7)Å
α=73.338(2)° β=89.974(2)° γ=84.594(2)°
TGF Beta
C22H19N5OC3H8O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=7.7720(11)Å b=11.8319(18)Å c=12.8267(17)Å
α=89.030(9)° β=74.293(8)° γ=82.225(10)°
TGF Beta
C26H29N5O2
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=8.1145(8)Å b=12.0611(13)Å c=12.5401(13)Å
α=88.454(5)° β=79.842(4)° γ=76.813(5)°
TGF beta
C22H19N5OC4H10O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=8.1676(2)Å b=11.9112(3)Å c=12.7014(3)Å
α=89.4745(11)° β=81.2360(14)° γ=75.9211(11)°
TGF Beta
C22H19N5O,2(C4H8O2)
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=10.6011(8)Å b=11.6654(9)Å c=12.5667(9)Å
α=69.035(3)° β=86.603(2)° γ=81.573(2)°
TGF beta
C22H19N5O,0.5(C4H8O2),H2O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=7.7332(3)Å b=11.4956(4)Å c=12.1986(4)Å
α=85.299(2)° β=84.505(2)° γ=85.518(2)°
TGF Beta
C22H19N5O,C4H8O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=8.3929(7)Å b=11.7452(9)Å c=12.0347(10)Å
α=92.483(3)° β=106.415(4)° γ=97.071(4)°
TGF beta
C22H19N5O,CH2Cl2
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=8.4961(8)Å b=10.3766(10)Å c=12.7043(12)Å
α=103.239(5)° β=91.904(5)° γ=94.505(5)°
C22H19N5O,C4H10O
C22H19N5O,C4H10O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=8.1840(8)Å b=12.0219(12)Å c=12.6533(12)Å
α=89.543(6)° β=81.238(6)° γ=75.349(6)°
C22H19N5O,C2H6O
C22H19N5O,C2H6O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=8.1100(4)Å b=11.6569(6)Å c=12.7599(6)Å
α=90.026(4)° β=99.248(4)° γ=101.238(4)°
C22H19N5O,C2H4O2
C22H19N5O,C2H4O2
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=9.5331(11)Å b=10.9792(13)Å c=11.6291(17)Å
α=66.668(12)° β=65.944(8)° γ=78.915(9)°
C22H19N5OC3H8O
C22H19N5OC3H8O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=8.0480(8)Å b=11.4825(13)Å c=12.8727(13)Å
α=89.280(7)° β=80.416(7)° γ=79.313(7)°
TGF beta
C22H19N5O,C5H10O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=8.5823(11)Å b=11.0257(18)Å c=12.7778(16)Å
α=101.925(12)° β=92.429(11)° γ=97.579(12)°
TGF beta
C22H19N5OC4H8O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=12.1495(14)Å b=8.4511(9)Å c=20.111(2)Å
α=90° β=93.551(7)° γ=90°
TGF beta
C22H19N5O,C5H9NO
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=9.9660(6)Å b=33.730(2)Å c=7.3404(5)Å
α=90° β=106.892(2)° γ=90°
C36H28N4O4
C36H28N4O4
Crystal Growth & Design (2003) 3, 6 909-919
a=10.3335(18)Å b=27.611(5)Å c=4.9960(9)Å
α=90.00° β=102.275(3)° γ=90.00°
C17H16N2O3
C17H16N2O3
Crystal Growth & Design (2003) 3, 6 909-919
a=5.1206(4)Å b=15.7136(13)Å c=18.4986(15)Å
α=90.00° β=96.5460(10)° γ=90.00°
C16H14N2O3
C16H14N2O3
Crystal Growth & Design (2003) 3, 6 909-919
a=5.2031(9)Å b=14.741(2)Å c=17.882(3)Å
α=90.00° β=98.132(3)° γ=90.00°
C18H18N2O2
C18H18N2O2
Crystal Growth & Design (2003) 3, 6 909-919
a=7.3985(15)Å b=8.9054(18)Å c=11.873(2)Å
α=95.809(3)° β=93.401(4)° γ=101.362(3)°
C19H20N2O3
C19H20N2O3
Crystal Growth & Design (2003) 3, 6 909-919
a=9.1567(12)Å b=10.1745(13)Å c=10.5116(14)Å
α=72.850(2)° β=70.288(2)° γ=67.269(2)°
C21H18N4O2
C21H18N4O2
Crystal Growth & Design (2003) 3, 6 909-919
a=5.0961(8)Å b=17.595(3)Å c=19.647(3)Å
α=90.00° β=90.917(3)° γ=90.00°
C22H17N3O4S
C22H17N3O4S
Crystal Growth & Design (2003) 3, 6 909-919
a=7.5140(11)Å b=10.4538(15)Å c=12.6826(18)Å
α=83.642(2)° β=85.697(2)° γ=75.411(2)°
C47H40N6O16
C47H40N6O16
Crystal Growth & Design (2003) 3, 6 909-919
a=34.355(8)Å b=5.3795(13)Å c=23.654(6)Å
α=90.00° β=93.952(6)° γ=90.00°
C44H40N4O10
C44H40N4O10
Crystal Growth & Design (2003) 3, 6 909-919
a=18.388(4)Å b=12.682(3)Å c=16.429(3)Å
α=90.00° β=100.491(6)° γ=90.00°
C34H36N4O4S2
C34H36N4O4S2
Crystal Growth & Design (2003) 3, 6 909-919
a=7.3254(19)Å b=8.889(2)Å c=12.208(3)Å
α=94.840(5)° β=94.926(5)° γ=100.048(5)°
C16H15N3O2
C16H15N3O2
Crystal Growth & Design (2003) 3, 6 909-919
a=5.1077(11)Å b=16.057(3)Å c=17.752(4)Å
α=73.711(3)° β=89.350(3)° γ=88.636(3)°
C38H30N4O4
C38H30N4O4
Crystal Growth & Design (2003) 3, 6 909-919
a=29.191(16)Å b=4.962(3)Å c=20.316(11)Å
α=90.00° β=92.105(8)° γ=90.00°
C22H19N5O
C22H19N5O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=10.7270(3)Å b=14.4711(5)Å c=12.7050(4)Å
α=90° β=107.1120(17)° γ=90°
C22H19N5O,H2O
C22H19N5O,H2O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=9.0505(7)Å b=11.3624(9)Å c=19.1323(16)Å
α=90° β=94.954(3)° γ=90°
TGF Beta
C22H19N5OC5H12O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=8.0879(6)Å b=12.3578(9)Å c=12.8909(9)Å
α=85.722(3)° β=77.875(3)° γ=74.707(3)°
TGF beta
C22H19N5O,C4H9NO
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=8.6946(4)Å b=10.9640(4)Å c=12.9344(5)Å
α=77.7370(16)° β=88.5612(17)° γ=79.1558(19)°
C22H19N5O,C4H8O
C22H19N5O,C4H8O
Journal of the American Chemical Society (2019) 141, 35 13887-13897
a=9.8533(7)Å b=11.2079(6)Å c=11.5743(6)Å
α=101.869(2)° β=105.813(2)° γ=105.560(2)°
C24H18N2O7
C24H18N2O7
Crystal Growth & Design (2003) 3, 6 909-919
a=32.531(5)Å b=5.2697(8)Å c=24.159(4)Å
α=90.00° β=98.191(3)° γ=90.00°