Crystallography Open Database

Information card for entry 8107526

Preview

Coordinates	8107526.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	The crystal structure of (E)-N'-(4-hydroxy-3-methoxybenzylidene)-2- naphthohydrazide monohydrate
Formula	C19 H18 N2 O4
Calculated formula	C19 H18 N2 O4
SMILES	c1c(ccc2ccccc12)C(=O)N/N=C/c1cc(c(cc1)O)OC.O
Title of publication	The crystal structure of (E)-N′-(4-hydroxy-3-methoxybenzylidene)-2-naphthohydrazide monohydrate, C19H18N2O4
Authors of publication	Zhang, Sheng-Ting; Zou, Fei; Lai, Ni; Yuan, Lin; Li, Zhong-Yan
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2023
Journal volume	238
Journal issue	4
Pages of publication	671 - 672
a	8.375 ± 0.002 Å
b	22.018 ± 0.006 Å
c	9.237 ± 0.003 Å
α	90°
β	106.271 ± 0.003°
γ	90°
Cell volume	1635.1 ± 0.8 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0609
Residual factor for significantly intense reflections	0.0427
Weighted residual factors for significantly intense reflections	0.1068
Weighted residual factors for all reflections included in the refinement	0.1185
Goodness-of-fit parameter for all reflections included in the refinement	1.064
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
286446 (current)	2023-09-21	cif/ Adding structures of 8107526 via cif-deposit CGI script.	8107526.cif