Structures by: McNab H.
Total: 76
C11H16N4O
C11H16N4O
Organic & biomolecular chemistry (2003) 1, 23 4268-4274
a=10.483(5)Å b=9.356(4)Å c=12.297(3)Å
α=90.00° β=101.14(3)° γ=90.00°
C11H8N4O
C11H8N4O
Organic & biomolecular chemistry (2010) 8, 22 5166-5173
a=9.6400(4)Å b=5.6225(2)Å c=17.8376(7)Å
α=90.00° β=100.381(2)° γ=90.00°
C7H5NO2
C7H5NO2
Organic & biomolecular chemistry (2010) 8, 19 4383-4387
a=5.1445(9)Å b=14.134(2)Å c=8.0639(15)Å
α=90.00° β=90.00° γ=90.00°
C13H9N3O2
C13H9N3O2
Organic & biomolecular chemistry (2010) 8, 19 4383-4387
a=6.1911(3)Å b=7.8957(4)Å c=21.7772(10)Å
α=90° β=91.924(3)° γ=90°
C10H8N2O
C10H8N2O
New Journal of Chemistry (2009) 33, 8 1703
a=7.6509(2)Å b=9.1569(3)Å c=12.0975(4)Å
α=102.228(2)° β=93.332(2)° γ=99.815(2)°
C11H12N2O2
C11H12N2O2
New Journal of Chemistry (2009) 33, 8 1703
a=4.5748(3)Å b=13.0074(9)Å c=17.0717(12)Å
α=90° β=90° γ=90°
C13H14N2O2S2
C13H14N2O2S2
New Journal of Chemistry (2009) 33, 8 1703
a=8.0365(2)Å b=8.9123(2)Å c=11.2816(3)Å
α=98.8420(10)° β=107.7310(10)° γ=111.5210(10)°
C10H16N2O2S
C10H16N2O2S
Dalton transactions (Cambridge, England : 2003) (2006) 16 2026-2034
a=11.9460(8)Å b=7.8174(5)Å c=13.1025(9)Å
α=90.00° β=108.5310(10)° γ=90.00°
C17H22N2O2S
C17H22N2O2S
Dalton transactions (Cambridge, England : 2003) (2006) 16 2026-2034
a=22.113(3)Å b=8.4446(14)Å c=8.9661(8)Å
α=90.00° β=90.00° γ=90.00°
C14H24N2O2S
C14H24N2O2S
Dalton transactions (Cambridge, England : 2003) (2006) 16 2026-2034
a=15.891(3)Å b=6.5484(12)Å c=15.549(3)Å
α=90.00° β=105.131(15)° γ=90.00°
C9H14N2O2S
C9H14N2O2S
Dalton transactions (Cambridge, England : 2003) (2006) 16 2026-2034
a=6.4295(17)Å b=7.0606(19)Å c=22.987(6)Å
α=90.00° β=90.097(5)° γ=90.00°
C19H30N4O5S2Zn
C19H30N4O5S2Zn
Dalton transactions (Cambridge, England : 2003) (2006) 16 2026-2034
a=15.636(6)Å b=25.789(8)Å c=11.784(6)Å
α=90.00° β=90.18(3)° γ=90.00°
C18H26N4NiO4S2
C18H26N4NiO4S2
Dalton transactions (Cambridge, England : 2003) (2006) 16 2026-2034
a=12.832(6)Å b=6.912(3)Å c=12.253(5)Å
α=90.00° β=108.68(3)° γ=90.00°
C24H38CuN4O4S2
C24H38CuN4O4S2
Dalton transactions (Cambridge, England : 2003) (2006) 16 2026-2034
a=6.2601(15)Å b=10.817(3)Å c=19.487(5)Å
α=90.00° β=94.534(4)° γ=90.00°
C13H14N2O2S
C13H14N2O2S
Dalton transactions (Cambridge, England : 2003) (2006) 16 2026-2034
a=11.245(8)Å b=6.100(5)Å c=18.916(17)Å
α=90.00° β=98.50(8)° γ=90.00°
C15H12N2O2
C15H12N2O2
Dalton transactions (Cambridge, England : 2003) (2010) 39, 30 7147-7152
a=7.1962(8)Å b=7.8951(9)Å c=22.354(3)Å
α=90.00° β=95.317(2)° γ=90.00°
C18H12N2O2
C18H12N2O2
Dalton transactions (Cambridge, England : 2003) (2010) 39, 30 7147-7152
a=14.333(9)Å b=25.751(16)Å c=7.859(5)Å
α=90.00° β=90.00° γ=90.00°
C17H15NO2
C17H15NO2
Dalton transactions (Cambridge, England : 2003) (2010) 39, 30 7147-7152
a=7.3474(6)Å b=7.9170(7)Å c=23.9413(19)Å
α=90.00° β=92.5930(10)° γ=90.00°
C14H10N2O2
C14H10N2O2
Dalton transactions (Cambridge, England : 2003) (2010) 39, 30 7147-7152
a=7.7628(6)Å b=7.7446(6)Å c=38.063(3)Å
α=90.00° β=90.00° γ=90.00°
C14H11N3O2
C14H11N3O2
Dalton transactions (Cambridge, England : 2003) (2010) 39, 30 7147-7152
a=7.7474(16)Å b=8.2529(18)Å c=10.230(2)Å
α=86.580(3)° β=82.200(3)° γ=71.914(3)°
C13H9N3O2
C13H9N3O2
Dalton transactions (Cambridge, England : 2003) (2010) 39, 30 7147-7152
a=7.519(5)Å b=7.223(5)Å c=10.049(7)Å
α=90.00° β=103.631(11)° γ=90.00°
C11H7NO
C11H7NO
Journal of the Chemical Society, Perkin Transactions 1 (1999) 15 2047
a=5.3646(5)Å b=13.6245(14)Å c=22.377(2)Å
α=90.00° β=90.00° γ=90.00°
C10H6N2O
C10H6N2O
Journal of the Chemical Society, Perkin Transactions 1 (1999) 15 2047
a=13.055(4)Å b=5.5116(14)Å c=21.840(5)Å
α=90.00° β=90.00° γ=90.00°
PYRROLIZIN-3-ONE
C7H5NO
Journal of the Chemical Society, Perkin Transactions 2 (2001) 11 2195
a=13.960(5)Å b=5.954(2)Å c=14.181(5)Å
α=90.00° β=104.42(4)° γ=90.00°
C7H7NO
C7H7NO
Journal of the Chemical Society, Perkin Transactions 2 (2001) 11 2195
a=6.629(5)Å b=12.996(9)Å c=7.373(5)Å
α=90.00° β=109.78(5)° γ=90.00°
Methyl 2-(9H-carbazol-9-yl)benzoate
C20H15N1O2
CrystEngComm (2010) 12, 9 2520
a=7.6168(2)Å b=15.2552(5)Å c=52.3376(16)Å
α=90° β=89.976(2)° γ=90°
Methyl 2-(9H-carbazol-9-yl)benzoate
C20H15N1O2
CrystEngComm (2010) 12, 9 2520
a=7.3592(7)Å b=14.601(2)Å c=51.188(9)Å
α=90° β=89.989(10)° γ=90°
Methyl 2-(9H-carbazol-9-yl)benzoate
C20H15N1O2
CrystEngComm (2010) 12, 9 2520
a=7.2634(3)Å b=14.4120(11)Å c=50.836(4)Å
α=90° β=89.966(5)° γ=90°
Methyl 2-(9H-carbazol-9-yl)benzoate
C20H15N1O2
CrystEngComm (2010) 12, 9 2520
a=7.6837(2)Å b=15.5843(6)Å c=52.1546(16)Å
α=90° β=89.933(2)° γ=90°
Methyl 2-(9H-carbazol-9-yl)benzoate
C20H15N1O2
CrystEngComm (2010) 12, 9 2520
a=7.1346(6)Å b=14.165(2)Å c=50.433(8)Å
α=90° β=89.880(9)° γ=90°
Methyl 2-(9H-carbazol-9-yl)benzoate
C20H15N1O2
CrystEngComm (2010) 12, 9 2520
a=7.701(2)Å b=12.569(6)Å c=24.786(13)Å
α=90° β=90° γ=90°
Methyl 2-(9H-carbazol-9-yl)benzoate
C20H15N1O2
CrystEngComm (2010) 12, 9 2520
a=7.0316(6)Å b=14.0254(19)Å c=50.157(8)Å
α=90° β=89.796(9)° γ=90°
Methyl 2-(9H-carbazol-9-yl)benzoate
C20H15N1O2
CrystEngComm (2010) 12, 9 2520
a=7.6475(7)Å b=12.451(3)Å c=24.651(2)Å
α=90° β=90° γ=90°
Methyl 2-(9H-carbazol-9-yl)benzoate
C20H15N1O2
CrystEngComm (2010) 12, 9 2520
a=7.6285(8)Å b=12.299(3)Å c=24.555(3)Å
α=90° β=90° γ=90°
C5H6OS
C5H6OS
Acta Crystallographica Section B (1999) 55, 6 963-974
a=6.848(3)Å b=7.540(4)Å c=11.111(5)Å
α=90.00° β=106.010(5)° γ=90.00°
C5H6OS
C5H6OS
Acta Crystallographica Section B (1999) 55, 6 963-974
a=6.641(4)Å b=7.109(4)Å c=11.594(5)Å
α=90.00° β=90.00° γ=90.00°
C7H8O2S
C7H8O2S
Acta Crystallographica Section B (1999) 55, 6 963-974
a=7.5941(9)Å b=7.8219(10)Å c=7.9811(9)Å
α=63.112(5)° β=64.660(5)° γ=89.636(5)°
C5H3NOS
C5H3NOS
Acta Crystallographica Section B (1999) 55, 6 963-974
a=7.516(2)Å b=8.332(2)Å c=9.059(2)Å
α=90.00° β=100.19(3)° γ=90.00°
C5H6OS2
C5H6OS2
Acta Crystallographica Section B (1999) 55, 6 963-974
a=19.513(6)Å b=8.083(2)Å c=4.046(2)Å
α=90.00° β=90.00° γ=90.00°
C9H12OS
C9H12OS
Acta Crystallographica Section B (1999) 55, 6 963-974
a=10.826(2)Å b=17.065(2)Å c=19.190(3)Å
α=90.00° β=91.011(12)° γ=90.00°
C9H13NO5
C9H13NO5
Acta Crystallographica Section E (2003) 59, 6 o841-o842
a=6.477(5)Å b=7.769(5)Å c=11.675(12)Å
α=98.04(7)° β=100.50(7)° γ=112.71(5)°
Compound 6.H~2~O
C5H6N2O,H2O
Acta Crystallographica Section C (1996) 52, 10 2622-2627
a=6.903(2)Å b=6.302(2)Å c=14.406(3)Å
α=90.00° β=92.12(3)° γ=90.00°
Compound 5
C5H6N2O
Acta Crystallographica Section C (1996) 52, 10 2622-2627
a=11.8328(16)Å b=7.5583(14)Å c=12.387(3)Å
α=90.00° β=90.00° γ=90.00°
Compound 8
C11H10N2O
Acta Crystallographica Section C (1996) 52, 10 2622-2627
a=5.700(4)Å b=26.428(18)Å c=6.712(5)Å
α=90.00° β=110.94(7)° γ=90.00°
Compound 7.H~2~O
C5H8N2O2
Acta Crystallographica Section C (1996) 52, 10 2622-2627
a=6.325(2)Å b=6.322(3)Å c=15.597(4)Å
α=90.00° β=90.00° γ=90.00°
C12H12O4S2
C12H12O4S2
Acta Crystallographica Section C (1998) 54, 2 234-236
a=6.137(8)Å b=7.170(8)Å c=15.00(3)Å
α=79.00(8)° β=84.36(11)° γ=83.08(8)°
7-Phenyl-1,2,3,4,-tetrahydro-1,4-diazepin-5-one
C11H12N2O
Acta Crystallographica Section C (1999) 55, 10 1725-1727
a=12.1685(19)Å b=13.724(2)Å c=13.315(3)Å
α=90.00° β=114.792(9)° γ=90.00°
5-(1,2-Diaza-3-methyl-1-phenylbutadien-4-ylidene)-Meldrum's acid
C15H16N2O4
Acta Crystallographica Section C (1995) 51, 3 527-529
a=7.544(3)Å b=8.576(3)Å c=12.014(7)Å
α=78.01(3)° β=83.36(3)° γ=71.41(3)°
Methyl 2-(t-Butylthio)cinnamate
C14H18O2S
Acta Crystallographica Section C (1995) 51, 3 509-511
a=5.8813(14)Å b=15.474(3)Å c=14.919(6)Å
α=90.00° β=95.64(3)° γ=90.00°
Methyl (E)-3-(imidazol-4-yl)propenoate hemihydrate
C7H8N2O2,0.5H2O
Acta Crystallographica Section C (1997) 53, 8 1093-1097
a=7.498(3)Å b=12.564(4)Å c=16.296(13)Å
α=90.00° β=93.36(4)° γ=90.00°
Methyl (E)-3-(imidazol-2-yl)propenoate
C7H8N2O2
Acta Crystallographica Section C (1997) 53, 8 1093-1097
a=9.706(2)Å b=8.9898(9)Å c=17.714(3)Å
α=90.00° β=90.00° γ=90.00°
Methyl (E)-3-(pyrrol-2-yl)propenoate
C8H9NO2
Acta Crystallographica Section C (1997) 53, 8 1093-1097
a=10.795(3)Å b=8.2710(10)Å c=17.803(3)Å
α=90.00° β=92.957(15)° γ=90.00°
Methyl (Z)-3-(imidazol-2-yl)propenoate
C7H8N2O2
Acta Crystallographica Section C (1997) 53, 8 1093-1097
a=15.700(13)Å b=18.927(16)Å c=7.311(5)Å
α=90.00° β=100.13(6)° γ=90.00°
C14H15NO8
C14H15NO8
Acta Crystallographica Section C (1997) 53, 12 1956-1958
a=5.191(4)Å b=11.627(6)Å c=12.998(7)Å
α=75.80(4)° β=79.33(6)° γ=88.49(6)°
3-[N-(1,2,3,4-tetrahydroquinolinyl)]prop-2-enal
C12H13NO
Acta Crystallographica Section C (1996) 52, 11 2814-2818
a=8.3438(8)Å b=14.8912(15)Å c=15.5405(13)Å
α=90.00° β=90.00° γ=90.00°
3-(di-isopropylamino)prop-2-enal
C9H17NO
Acta Crystallographica Section C (1996) 52, 11 2814-2818
a=8.304(3)Å b=11.163(5)Å c=11.802(6)Å
α=102.08(3)° β=98.93(3)° γ=109.48(2)°
C19H18N2O7
C19H18N2O7
Acta Crystallographica Section C (1996) 52, 12 3064-3067
a=9.027(5)Å b=10.945(5)Å c=10.913(5)Å
α=112.790(5)° β=99.240(5)° γ=109.720(5)°
C9H7NO
C9H7NO
Acta Crystallographica Section C (1997) 53, 6 807-809
a=8.648(4)Å b=11.561(8)Å c=8.189(4)Å
α=90.00° β=114.43(4)° γ=90.00°
2-hydroxyacetophenone anil
C14H13N1O1
Acta Crystallographica Section C (1998) 54, 9 1360-1362
a=5.5431(5)Å b=8.9090(6)Å c=45.893(4)Å
α=90° β=90° γ=90°
2-hydroxybenzophenone anil
C19H15N1O1
Acta Crystallographica Section C (1998) 54, 9 1360-1362
a=18.339(3)Å b=9.6420(10)Å c=16.323(2)Å
α=90° β=90.26(2)° γ=90°
2,3-Dihydro-3-phenyl-1H-isoindol-1-one
C14H11NO
Acta Crystallographica Section C (1997) 53, 8 1098-1099
a=16.3820(8)Å b=6.1648(6)Å c=21.6676(12)Å
α=90.00° β=104.835(3)° γ=90.00°
3-acetoxymethylpyrrole-2-carbaldehyde
C8H9NO3
Acta Crystallographica Section C (1995) 51, 11 2348-2350
a=4.463(3)Å b=11.546(5)Å c=15.697(5)Å
α=90.00° β=95.75(5)° γ=90.00°
C6H7NO2
C6H7NO2
Acta Crystallographica Section C (1998) 54, 2 231-233
a=6.9093(9)Å b=12.380(2)Å c=7.3256(11)Å
α=90.00° β=107.781(10)° γ=90.00°
C18H22O4S1
C18H22O4S1
Acta Crystallographica Section C (1998) 54, 2 234-236
a=9.4818(9)Å b=9.7365(4)Å c=10.6089(10)Å
α=93.469(8)° β=113.697(5)° γ=97.890(8)°
5-phenylthiomethylene (Meldrum's acid)
C13H12O4S
Acta Crystallographica Section C (1994) 50, 11 1716-1717
a=15.2742(14)Å b=7.1069(6)Å c=12.5036(13)Å
α=90.00° β=110.744(7)° γ=90.00°
2',4',6'-trihydroxy-1-methoxyacetophenone
C9H10O5,H2O
Acta Crystallographica Section C (2001) 57, 2 211-212
a=17.3138(5)Å b=7.33300(10)Å c=16.8507(5)Å
α=90.00° β=117.8380(10)° γ=90.00°
5-(1-aminopyrrolylmethylene)-Meldrum's acid
C11H12N2O4
Acta Crystallographica Section C (1994) 50, 12 1935-1938
a=16.7900(11)Å b=12.6423(8)Å c=11.1014(6)Å
α=90.00° β=94.31(6)° γ=90.00°
5-(1-aminopyrazolylmethylene)-Meldrum's acid
C10H11N3O4
Acta Crystallographica Section C (1994) 50, 12 1935-1938
a=5.4407(10)Å b=10.341(2)Å c=10.714(2)Å
α=107.351(7)° β=96.814(11)° γ=100.900(15)°
Α-pyrone
C5H4O2
Acta Crystallographica Section C (1994) 50, 12 1938-1940
a=19.263(10)Å b=3.886(3)Å c=5.902(3)Å
α=90.00° β=90.00° γ=90.00°
2-chloro-4-methoxy-6-methyl-1,3,5-triazine
C5H6ClN3O
Acta Crystallographica Section C (1994) 50, 9 1497-1498
a=7.6358(12)Å b=6.5671(15)Å c=13.746(2)Å
α=90.00° β=90.00° γ=90.00°
1,1,-dimethyl-5-phenyl-1,2,5-triazapentadienium picrate
C10H14N31,C6H2N3O71
Acta Crystallographica Section C (1994) 50, 9 1499-1501
a=12.7783(15)Å b=9.5867(12)Å c=8.2046(12)Å
α=80.066(6)° β=108.617(9)° γ=95.533(8)°
1-[(2-phenylsulfanyl)phenyl]ethanone
C14H12OS
Acta Crystallographica Section C (2001) 57, 10 1174-1176
a=9.0151(7)Å b=12.7805(14)Å c=10.6400(12)Å
α=90.00° β=105.497(7)° γ=90.00°
1-[(2-phenylmethylsulfanyl)phenyl]ethanone
C15H14OS
Acta Crystallographica Section C (2001) 57, 10 1174-1176
a=7.8838(18)Å b=14.719(3)Å c=21.277(4)Å
α=90.00° β=90.00° γ=90.00°
C16H10N2.2H2O
C16H10N2.2H2O
Journal of the American Chemical Society (2007) 129, 476-477
a=13.3373(9)Å b=7.1636(5)Å c=26.4564(18)Å
α=90.00° β=90.00° γ=90.00°
C19H11N3
C19H11N3
Journal of the American Chemical Society (2007) 129, 476-477
a=13.7096(9)Å b=7.1732(5)Å c=14.1350(9)Å
α=90.00° β=110.494(4)° γ=90.00°
3[(C19H11N3),(C5H8N3),(C24H20B)],5(C2H3N)
3[(C19H11N3),(C5H8N3),(C24H20B)],5(C2H3N)
Journal of the American Chemical Society (2009) 131, 14116-14122
a=36.323(12)Å b=10.166(3)Å c=34.552(10)Å
α=90.00° β=99.372(9)° γ=90.00°