Crystallography Open Database

Information card for entry 2023498

2023497 << 2023498 >> 2023499

Preview

Coordinates	2023498.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	(<i>E</i>)-3,4,5-Trihydroxy-<i>N</i>'-(3,4,5-trimethoxybenzylidene)benzohydrazide monohydrate
Formula	C17 H20 N2 O8
Calculated formula	C17 H20 N2 O8
Title of publication	Synthesis and structure of (E)-3,4,5-trihydroxy-N′-(3,4,5-trimethoxybenzylidene)benzohydrazide monohydrate
Authors of publication	Lo, Mamadou; Sene, Bineta; Pouye, Adji Fatou Fall; Lee, Arie van der; Gassama, Abdoulaye; Richeter, Sébastien
Journal of publication	Acta Crystallographica Section E Crystallographic Communications
Year of publication	2025
Journal volume	81
Journal issue	6
a	11.5409 ± 0.0007 Å
b	10.9018 ± 0.0006 Å
c	14.3799 ± 0.0008 Å
α	90°
β	103.427 ± 0.002°
γ	90°
Cell volume	1759.78 ± 0.17 Å³
Cell temperature	173 K
Ambient diffraction temperature	173 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	0.055
Residual factor for significantly intense reflections	0.0349
Weighted residual factors for significantly intense reflections	0.0551
Weighted residual factors for all reflections included in the refinement	0.0621
Goodness-of-fit parameter for all reflections included in the refinement	1.084
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
299649 (current)	2025-05-14	cif/ Adding structures of 2023498 via cif-deposit CGI script.	2023498.cif