Crystallography Open Database

Information card for entry 2208633

2208632 << 2208633 >> 2208634

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Structure parameters

Chemical name	2'-(1H-Indol-3-ylmethylene)isonicotinohydrazide ethanol solvate
Formula	C17 H18 N4 O2
Calculated formula	C17 H18 N4 O2
SMILES	O=C(NN=Cc1c2ccccc2[nH]c1)c1ccncc1.OCC
Title of publication	2'-(1<i>H</i>-Indol-3-ylmethylene)isonicotinohydrazide ethanol solvate
Authors of publication	Jing, Zuo-Liang; Cheng, Wen-Wen; Chen, Xin; Yu Ming
Journal of publication	Acta Crystallographica Section E
Year of publication	2006
Journal volume	62
Journal issue	4
Pages of publication	o1360 - o1361
a	9.608 ± 0.0014 Å
b	10.0047 ± 0.0015 Å
c	16.791 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	1614 ± 0.4 Å³
Cell temperature	294 ± 2 K
Ambient diffraction temperature	294 ± 2 K
Number of distinct elements	4
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0368
Residual factor for significantly intense reflections	0.0343
Weighted residual factors for significantly intense reflections	0.099
Weighted residual factors for all reflections included in the refinement	0.1013
Goodness-of-fit parameter for all reflections included in the refinement	1.063
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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