Crystallography Open Database

Information card for entry 8106903

Preview

Coordinates	8106903.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H15 N3 O2
Calculated formula	C14 H15 N3 O2
Title of publication	Crystal structure of N′-(2-hydroxybenzylidene)-3,4-dimethyl-1H-pyrrole-2-carbohydrazide, C14H15N3O2
Authors of publication	Qiao, Wen-Tao; Li, Hai-Yan; Wang, Yuan
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2016
Journal volume	231
Journal issue	2
Pages of publication	445 - 446
a	8.2642 ± 0.0004 Å
b	6.0481 ± 0.0003 Å
c	25.6897 ± 0.0011 Å
α	90°
β	95.319 ± 0.003°
γ	90°
Cell volume	1278.51 ± 0.1 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
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	0.121
Residual factor for significantly intense reflections	0.0493
Weighted residual factors for significantly intense reflections	0.1132
Weighted residual factors for all reflections included in the refinement	0.1398
Goodness-of-fit parameter for all reflections included in the refinement	1.003
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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