Structures by: McClenaghan I.
Total: 67
Α-Ammonium-α-methylpropionoate
NH41,C4H5O21
Acta Crystallographica Section E (2002) 58, 7 o706-o707
a=10.6273(8)Å b=9.0102(8)Å c=11.3370(7)Å
α=90.00° β=93.749(6)° γ=90.00°
Benzocaine
C9H11NO2
Acta Crystallographica Section E (2002) 58, 7 o708-o709
a=8.198(2)Å b=5.4300(10)Å c=19.592(5)Å
α=90.00° β=91.350(6)° γ=90.00°
Ethyl 4-phenyl-2-(N-pyrrole)-1,3-thiazole-5-carboxylate
C16H14N2O2S
Acta Crystallographica Section E (2002) 58, 7 o745-o746
a=10.2375(4)Å b=3.9460(2)Å c=35.075(2)Å
α=90.00° β=91.979(2)° γ=90.00°
3-(4-(Methylsulfonyl)benzoyl)propionic acid
C11H12O5S
Acta Crystallographica Section E (2002) 58, 7 o729-o730
a=5.18510(10)Å b=10.5030(3)Å c=10.9550(4)Å
α=96.9900(10)° β=101.1350(10)° γ=101.786(3)°
Ethyl 4-tert-butyl-2-(3-phenylureido)-1,3-thiazole-5-carboxylate
C17H21N3O3S
Acta Crystallographica Section E (2002) 58, 7 o733-o734
a=6.1391(4)Å b=9.9755(6)Å c=28.248(2)Å
α=90.00° β=90.00° γ=90.00°
2-(N,N-Dimethylaminomethyl)-4-hydroxy-4-phenyl-2-thiazoline
C12H15ClN2OS
Acta Crystallographica Section E (2002) 58, 7 o710-o711
a=6.1186(8)Å b=9.3865(9)Å c=11.977(2)Å
α=103.473(4)° β=97.274(5)° γ=93.320(10)°
Diethyl (4-tert-butyl-1,3-thiazol-2-ylaminomethylene)malonate
C15H23N2O4S
Acta Crystallographica Section E (2003) 59, 2 o242-o243
a=19.663(4)Å b=13.177(3)Å c=13.708(3)Å
α=90.00° β=103.69(3)° γ=90.00°
2-Amino-4-(4-chlorophenylthio)-5-phenyl-6-(1-piperidyl)pyrimidine
C21H21ClN4S
Acta Crystallographica Section E (2003) 59, 2 o222-o224
a=14.645(3)Å b=6.4302(13)Å c=20.954(4)Å
α=90.00° β=98.67(3)° γ=90.00°
2-(4-Methoxyphenyl)-5-(4-methylpent-3-enyl)-2,3,3a,4,7,7a-hexahydro- 1H-isoindole-1,3-dione
C21H25NO3
Acta Crystallographica Section E (2003) 59, 2 o198-o199
a=17.001(2)Å b=6.5492(10)Å c=17.145(3)Å
α=90.00° β=110.584(5)° γ=90.00°
2-Chloro-3-(3-dimethylaminopropylamino)-1,4-naphthoquinone
C15H17ClN2O2
Acta Crystallographica Section E (2003) 59, 9 o1427-o1428
a=8.0693(8)Å b=13.0020(10)Å c=13.931(2)Å
α=90.00° β=105.623(4)° γ=90.00°
4-Chloro-2-methylthio-6-(piperidin-1-yl)pyrimidine
C10H14ClN3S
Acta Crystallographica Section E (2001) 57, 3 o200-o201
a=13.189(3)Å b=8.577(2)Å c=20.195(4)Å
α=90.00° β=90.00° γ=90.00°
4,6-Dichloro-2-methylthio-5-phenylpyrimidine
C11H8Cl2N2S
Acta Crystallographica Section E (2001) 57, 3 o264-o265
a=7.467(2)Å b=16.217(3)Å c=19.318(4)Å
α=90.00° β=90.00° γ=90.00°
6-Chloro-2-methylthio-4-[(2-phenylethyl)amino]pyrimidine
C26H28Cl2N6S2
Acta Crystallographica Section E (2001) 57, 3 o198-o199
a=20.038(4)Å b=11.358(2)Å c=12.043(2)Å
α=90.00° β=92.03(3)° γ=90.00°
1-(3-Chloro-4-methylphenyl)pyrroline-2,5-dione
C11H8ClNO2
Acta Crystallographica Section E (2001) 57, 2 o147-o148
a=10.473(2)Å b=24.303(5)Å c=3.8594(8)Å
α=90.00° β=90.00° γ=90.00°
2-Chloro-3-(4-methylpiperizino)-1,4-naphthoquinone
C15H15ClN2O2
Acta Crystallographica Section E (2001) 57, 3 o287-o288
a=12.379(3)Å b=9.389(2)Å c=12.995(3)Å
α=90.00° β=116.60(3)° γ=90.00°
N-(4-Acetylphenyl)maleamic acid
C12H11NO4
Acta Crystallographica Section E (2002) 58, 6 o678-o679
a=5.5577(3)Å b=25.5016(14)Å c=7.4588(5)Å
α=90.00° β=95.134(2)° γ=90.00°
3-Cyano-6-(4-methoxyphenyl)-2(1H)-pyridone
C13H10N2O2
Acta Crystallographica Section E (2002) 58, 6 o680-o681
a=10.6650(7)Å b=9.8140(8)Å c=11.1544(12)Å
α=90.00° β=108.833(3)° γ=90.00°
4-Methyl-2-(8-quinolyl)phthalazin-1-one
C18H13N3O
Acta Crystallographica Section E (2002) 58, 10 o1051-o1052
a=7.9530(4)Å b=8.4914(6)Å c=10.8850(7)Å
α=77.060(6)° β=74.114(5)° γ=86.277(3)°
2-phenylpyrrolo[2,3-h]quinoline dihydrate
C17H12N2,2H2O
Acta Crystallographica Section E (2002) 58, 10 o1150-o1151
a=24.758(4)Å b=24.758(4)Å c=4.6952(9)Å
α=90.00° β=90.00° γ=90.00°
2-(Benzoylmethylsulfanyl)-6-methoxy-1H-benzimidazole
C16H14N2O2S
Acta Crystallographica Section E (2004) 60, 3 o363-o364
a=5.7681(3)Å b=9.8914(6)Å c=24.4281(16)Å
α=90.00° β=96.798(3)° γ=90.00°
2-Chloro-3-[4-(ethoxycarbonyl)-1-piperidyl]-1,4-naphthoquinone
C18H18ClNO4
Acta Crystallographica Section E (2001) 57, 2 o125-o126
a=12.780(3)Å b=16.931(3)Å c=7.8532(16)Å
α=90.00° β=101.85(3)° γ=90.00°
5-tert-butyl-4-nitro-1H-pyrazol-3-ol
C7H11N3O3
Acta Crystallographica Section E (2005) 61, 8 o2347-o2348
a=6.4870(5)Å b=6.6560(4)Å c=11.5588(8)Å
α=81.227(4)° β=76.733(3)° γ=65.037(5)°
5-tert-Butyl-4-bromo-1,2-dihydro-1H-pyrazol-3(2H)-one monohydrate
C7H11BrN2O,H2O
Acta Crystallographica Section E (2005) 61, 8 o2349-o2351
a=13.6840(4)Å b=13.6840(4)Å c=21.4734(8)Å
α=90.00° β=90.00° γ=90.00°
4-Hydroxy-6-methyl-2-(sulfonatoethylsulfanyl)pyrimidin-1-ium monohydrate
C7H10N2O4S2,H2O
Acta Crystallographica Section E (2004) 60, 3 o376-o377
a=6.1137(2)Å b=11.2202(3)Å c=15.9632(6)Å
α=90.00° β=91.0483(18)° γ=90.00°
8-(2-Phenylethylamino)quinoline
C17H16N2
Acta Crystallographica Section E (2001) 57, 1 o4-o5
a=10.1202(3)Å b=9.9645(3)Å c=13.8592(5)Å
α=90.00° β=110.7743(11)° γ=90.00°
4-Amino-6-imidium-1,3,5-dithiazol-4-ene iodide
C3H6N3S21,I1
Acta Crystallographica Section E (2001) 57, 1 o70-o71
a=11.050(2)Å b=18.964(4)Å c=8.1307(16)Å
α=90.00° β=108.87(3)° γ=90.00°
11H-Pyridinium[2,3h]-7,8,9,10-tetrahydrocarbazole chloride
C15H15N21,Cl1
Acta Crystallographica Section E (2001) 57, 1 o43-o44
a=15.9111(6)Å b=5.0374(2)Å c=17.1233(9)Å
α=90.00° β=113.9330(17)° γ=90.00°
4-Methoxy-3-nitropyridinium chloride
C6H7N2O31,Cl1
Acta Crystallographica Section E (2001) 57, 1 o83-o84
a=10.6185(4)Å b=7.1517(4)Å c=11.3701(5)Å
α=90.00° β=111.523(3)° γ=90.00°
8-(Isoindol-1,3-dione-2-yl)aminoquinoline
C17H11N3O2
Acta Crystallographica Section E (2001) 57, 1 o16-o17
a=16.397(3)Å b=10.819(2)Å c=7.6737(15)Å
α=90.00° β=90.00° γ=90.00°
2-Amino-4,6-bis(4-chlorophenylthio)pyrimidine
C32H22Cl4N6S4
Acta Crystallographica Section E (2001) 57, 1 o11-o12
a=28.4777(13)Å b=8.6020(3)Å c=14.2055(5)Å
α=90.00° β=102.5620(13)° γ=90.00°
2-Amino-5-(4-methoxybenzyl)-4-methyl-1,3-thiazolium chloride
C12H15ClN2OS
Acta Crystallographica Section E (2001) 57, 1 o24-o25
a=7.5746(15)Å b=11.878(2)Å c=14.519(3)Å
α=90.00° β=100.47(3)° γ=90.00°
2-Amino-4,6-bis(phenylthio)pyrimidine
C16H13N3S2
Acta Crystallographica Section E (2001) 57, 1 o26-o27
a=8.7937(18)Å b=8.3091(17)Å c=21.148(4)Å
α=90.00° β=95.73(3)° γ=90.00°
2-Amino-4-chloro-6-(4-carbamoylpyperidinyl)pyrimidine hemihydrate
C10H15ClN5O,0.5H2O
Acta Crystallographica Section E (2001) 57, 1 o50-o51
a=15.559(3)Å b=9.3139(19)Å c=16.493(3)Å
α=90.00° β=102.08(3)° γ=90.00°
(E)-1-(2-Thienyl)ethanone 8-quinolylhydrozone
C15H13N3S
Acta Crystallographica Section E (2001) 57, 1 o52-o53
a=10.148(2)Å b=14.251(3)Å c=18.103(4)Å
α=90.00° β=90.00° γ=90.00°
2-Chloro-4-methylquinoline
C10H8ClN
Acta Crystallographica Section E (2001) 57, 1 o54-o55
a=12.721(3)Å b=7.8961(16)Å c=16.617(3)Å
α=90.00° β=90.00° γ=90.00°
2-(4-Pyridyl)pyrrolo[3,2-h]quinoline
C32H22N6
Acta Crystallographica Section E (2001) 57, 1 o56-o57
a=19.3539(8)Å b=6.8609(3)Å c=19.3579(8)Å
α=90.00° β=112.325(2)° γ=90.00°
Thiazolidine-2,4-dione
C3H3NO2S
Acta Crystallographica Section E (2001) 57, 1 o79-o80
a=7.2926(2)Å b=9.3642(3)Å c=13.1208(5)Å
α=90.00° β=90.00° γ=90.00°
2-tert-Butyl-4,6-dinitrophenol
C10H12N2O5
Acta Crystallographica Section E (2004) 60, 8 o1288-o1289
a=9.974(2)Å b=10.575(2)Å c=11.547(2)Å
α=90.00° β=112.90(3)° γ=90.00°
Ethyl 2-(2-chloro-1,4-dihydro-1,4-dioxonaphthalen-3-ylamino)-4-phenylthiazole-5- carboxylate
C22H15ClN2O4S
Acta Crystallographica Section E (2005) 61, 3 o790-o791
a=19.191(5)Å b=7.719(2)Å c=12.640(3)Å
α=90.00° β=94.845(18)° γ=90.00°
Diethyl 2-aminothiazole-4,5-dicarboxylate hemihydrate
C9H12N2O4S,0.5H2O
Acta Crystallographica Section E (2005) 61, 4 o824-o826
a=16.7835(4)Å b=8.4580(2)Å c=18.0373(5)Å
α=90.00° β=111.6530(10)° γ=90.00°
2-Amino-4-(pyrid-4-yl)pyrimidine
C9H8N4
Acta Crystallographica Section C (2001) 57, 7 830-832
a=9.450(2)Å b=13.689(3)Å c=6.4390(10)Å
α=90° β=103.35(3)° γ=90°
2-Amino-4-(pyrid-4-yl)pyrimidine 4-aminobenzoic acid
C9H8N4,C7H7NO2
Acta Crystallographica Section C (2001) 57, 7 830-832
a=7.881(2)Å b=26.354(5)Å c=7.297(2)Å
α=90° β=102.04(3)° γ=90°
2-Amino-6-chloro-4-(1-phenylethylamino)pyrimidine
C12H13ClN4
Acta Crystallographica Section C (2000) 56, 11 e534-e534
a=17.4851(7)Å b=17.4851(6)Å c=16.2878(9)Å
α=90.00° β=90.00° γ=90.00°
4-Anilino-3-nitropyridine
C11H9N3O2
Acta Crystallographica Section C (2000) 56, 11 e535-e535
a=9.9036(2)Å b=19.9452(4)Å c=13.6660(3)Å
α=90.00° β=133.5610(10)° γ=90.00°
4,6-Dichloro-2-methylthiopyrimidine
C5H4Cl2N2S
Acta Crystallographica Section C (2000) 56, 11 e536-e536
a=13.6482(2)Å b=14.1294(2)Å c=14.1343(2)Å
α=119.9578(7)° β=95.9391(6)° γ=92.8349(7)°
C16H14N4
C16H14N4
Acta Crystallographica, Section C (2002) 58, o642-o644
a=10.1678(4)Å b=11.2970(6)Å c=11.3566(6)Å
α=90° β=90.284(3)° γ=90°
C15H14N4
C15H14N4
Acta Crystallographica, Section C (2002) 58, o642-o644
a=10.690(2)Å b=5.5066(11)Å c=21.363(4)Å
α=90° β=90° γ=90°
2-(pyrrolidin-1-yl)-1,4-naphthoquinone
C14H12.95Cl0.05NO2
Acta Crystallographica Section C (2002) 58, 12 o704-o707
a=11.5759(5)Å b=9.3063(4)Å c=11.5275(4)Å
α=90° β=118.896(2)° γ=90°
2-(phenylthio)-3-(pyrrolidin-1-yl)-1,4-naphthoquinone
C20H17NO2S
Acta Crystallographica Section C (2002) 58, 12 o704-o707
a=13.205(3)Å b=11.387(2)Å c=11.220(2)Å
α=90° β=93.12(3)° γ=90°
2-amino-6-chloropurine
C5H4ClN5
Acta Crystallographica Section C (2003) 59, 1 o53-o56
a=7.0855(10)Å b=7.0855(10)Å c=26.990(5)Å
α=90.00° β=90.00° γ=90.00°
2-amino-6-(4-chlorophenylthio)purine hemihydrate
C11H8ClN5S,0.5H2O
Acta Crystallographica Section C (2003) 59, 1 o53-o56
a=13.353(3)Å b=7.743(2)Å c=47.600(10)Å
α=90.00° β=95.85(3)° γ=90.00°
2-amino-6-(4-methylphenylthio)purine 1/3hydrate
C12H11N5S,0.333H2O
Acta Crystallographica Section C (2003) 59, 1 o53-o56
a=10.8074(2)Å b=11.6355(3)Å c=15.3922(3)Å
α=85.468(2)° β=83.2650(10)° γ=79.7992(9)°
6-Methylimidazo[2,1-b]thiazole 2-amino-1,3-thiazole
C6H6N2S,C3H4N2S
Acta Crystallographica Section C (2004) 60, 8 o592-o594
a=6.9195(2)Å b=9.1860(2)Å c=9.6953(3)Å
α=69.5204(17)° β=71.4823(16)° γ=74.2770(17)°
1-[4-nitro-2-(trifluoromethyl)phenyl]-4-phenylpiperazine
C17H16F3N3O2
Acta Crystallographica Section C (2004) 60, 1 o1-o5
a=13.390(3)Å b=9.853(2)Å c=12.503(3)Å
α=90° β=102.97(3)° γ=90°
1-[2-nitro-4-(trifluoromethyl)phenyl]-4-phenylpiperazine
C17H16F3N3O2
Acta Crystallographica Section C (2004) 60, 1 o1-o5
a=30.6687(12)Å b=9.9731(3)Å c=10.4592(3)Å
α=90° β=95.8496(10)° γ=90°
4-[4-nitro-2-(trifluoromethyl)phenyl]piperazine-1-carboxylate
C14H16F3N3O4
Acta Crystallographica Section C (2004) 60, 1 o1-o5
a=12.555(3)Å b=7.2688(15)Å c=17.366(4)Å
α=90° β=107.85(3)° γ=90°
4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carboxylate
C14H16F3N3O4
Acta Crystallographica Section C (2004) 60, 1 o1-o5
a=8.8211(18)Å b=11.717(2)Å c=15.528(3)Å
α=86.55(3)° β=81.97(3)° γ=90.00(3)°
Ethyl-2-amino-4-phenyl-1,3-thiazole-5-carboxylate
C12H12N2O2S
Acta Crystallographica Section C (2000) 56, 12 e586-e586
a=10.3124(2)Å b=8.6888(3)Å c=13.3156(3)Å
α=90.00° β=97.2427(15)° γ=90.00°
4-(Phenyl)thiosemicarbazide
C7H9N3S
Acta Crystallographica Section C (2000) 56, 12 e587-e587
a=11.9231(7)Å b=5.4888(3)Å c=12.3788(8)Å
α=90.00° β=91.527(3)° γ=90.00°
2-Chloro-3-pyrrolidino-1,4-naphthoquinone
C14H12ClNO2
Acta Crystallographica Section C (2000) 56, 12 e588-e588
a=11.2926(6)Å b=10.4429(4)Å c=11.2028(4)Å
α=90.00° β=115.829(15)° γ=90.00°
2-phenylmalonpiperadide
C19H26N2O2
Acta Crystallographica Section C (2003) 59, 12 o715-o718
a=6.1652(3)Å b=10.2718(5)Å c=26.1962(17)Å
α=90° β=90° γ=90°
2-phenylmalonmorpholide
C17H22N2O4
Acta Crystallographica Section C (2003) 59, 12 o715-o718
a=8.39000(10)Å b=10.8464(2)Å c=17.0838(4)Å
α=90° β=90° γ=90°
2-Acetamido-4-p-tolyl-1,3-thiazole
C12H12N2OS
Acta Crystallographica Section C (2004) 60, 11 o815-o817
a=3.9541(5)Å b=37.484(5)Å c=7.7173(9)Å
α=90.00° β=99.338(2)° γ=90.00°
2-amino-4-tolyl-1,3-thiazolium chloride dihydrate
C10H11N2S,Cl,2H2O
Acta Crystallographica Section C (2004) 60, 11 o815-o817
a=6.8815(6)Å b=9.3072(14)Å c=19.499(3)Å
α=90.00° β=90.00° γ=90.00°
5-(4-Fluorophenyl)-1-phenylpyrazole
C15H11FN2
Acta Crystallographica Section E (2002) 58, 7 o731-o732
a=7.847(2)Å b=7.904(2)Å c=19.551(4)Å
α=90.20(3)° β=100.92(3)° γ=90.61(3)°
2-Chloro-3-(4-morpholino)-1,4-naphthoquinone
C14H12ClNO3
Acta Crystallographica Section C (2000) 56, 11 e537-e537
a=5.03860(10)Å b=10.3948(2)Å c=12.7421(3)Å
α=67.2038(12)° β=84.4066(10)° γ=81.2678(12)°
Ethyl 2-amino-4-tert-butyl-1,3-thiazole-5-carboxylate
C10H16N2O2S
Acta Crystallographica Section C (2004) 60, 8 o592-o594
a=10.6248(8)Å b=8.6055(5)Å c=13.0135(9)Å
α=90.00° β=92.977(4)° γ=90.00°