Crystallography Open Database

Information card for entry 7211891

Preview

Coordinates	7211891.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H21 N6 O10 Zn2
Calculated formula	C24 H21 N6 O10 Zn2
Title of publication	Syntheses, structures, photoluminescence and magnetic properties of five compounds with 1,3,5-benzenetricarboxylate acid and imidazole ligands
Authors of publication	Xu, Jiao; Pan, Zhaorui; Wang, Tianwei; Li, Yizhi; Guo, Zijian; Batten, Stuart R.; Zheng, Hegen
Journal of publication	CrystEngComm
Year of publication	2010
Journal volume	12
Journal issue	2
Pages of publication	612
a	10.666 ± 0.002 Å
b	16.748 ± 0.003 Å
c	14.201 ± 0.003 Å
α	90°
β	95.299 ± 0.004°
γ	90°
Cell volume	2525.9 ± 0.8 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	0.0754
Residual factor for significantly intense reflections	0.0538
Weighted residual factors for significantly intense reflections	0.1541
Weighted residual factors for all reflections included in the refinement	0.1613
Goodness-of-fit parameter for all reflections included in the refinement	1.037
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
180449 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/18.	7211891.cif
92459	2014-01-12	cif/ Adding structures of 7211890, 7211891, 7211892, 7211893, 7211894 via cif-deposit CGI script.	7211891.cif