Crystallography Open Database

Information card for entry 8106939

Preview

Coordinates	8106939.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H20 Cl N3 O
Calculated formula	C18 H20 Cl N3 O
Title of publication	Crystal structure of (E)-4-chloro-N′-(4-(diethylamino)benzylidene)benzohydrazide, C18H20ClN3O
Authors of publication	Jiang, Xue-Yue; Chen, Lan-Lan; Hu, Sen-Sen; Liu, He-Yu; Xu, Hua-Jie; Song, Chong-Fu
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2016
Journal volume	231
Journal issue	2
Pages of publication	557 - 559
a	10.0099 ± 0.0003 Å
b	16.2337 ± 0.0006 Å
c	21.0714 ± 0.0007 Å
α	90°
β	91.324 ± 0.003°
γ	90°
Cell volume	3423.1 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0936
Residual factor for significantly intense reflections	0.0381
Weighted residual factors for significantly intense reflections	0.0927
Weighted residual factors for all reflections included in the refinement	0.1065
Goodness-of-fit parameter for all reflections included in the refinement	0.713
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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