Crystallography Open Database

Information card for entry 8106241

Preview

Coordinates	8106241.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H21 N3 O3
Calculated formula	C18 H21 N3 O3
Title of publication	Crystal structure of (E)-2-hydroxybenzaldehyde O-(2-(((E)-(4-(dimethylamino)benzylidene)amino)oxy)ethyl)oxime, C18H21N3O3
Authors of publication	Peng, Yun-Dong; Zhang, Yang; Ren, Zong-Li; Wang, Li; Dong, Wen-Kui
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2018
Journal volume	233
Journal issue	4
Pages of publication	635 - 636
a	5.3025 ± 0.0003 Å
b	9.7824 ± 0.0007 Å
c	33.3847 ± 0.0019 Å
α	90°
β	93.699 ± 0.006°
γ	90°
Cell volume	1728.1 ± 0.19 Å³
Cell temperature	290.7 ± 0.3 K
Ambient diffraction temperature	290.7 ± 0.3 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	0.1229
Residual factor for significantly intense reflections	0.0677
Weighted residual factors for significantly intense reflections	0.1521
Weighted residual factors for all reflections included in the refinement	0.1892
Goodness-of-fit parameter for all reflections included in the refinement	1.036
Diffraction radiation probe	x-ray
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
279540 (current)	2022-11-24	cif/ Adding structures of 8106241 via cif-deposit CGI script.	8106241.cif