Crystallography Open Database

Information card for entry 7214917

Preview

Coordinates	7214917.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H20 Cd N6 O8 S
Calculated formula	C28 H16 Cd N6 O8 S
Title of publication	Synthesis, structural characterization and photoluminescence property of four di(mono)acylhydrazidate-coordinated Cd2+ and Zn2+ compounds
Authors of publication	Jin, Juan; Bai, Fu-Quan; Li, Guang-Hua; Jia, Ming-Jun; Zhao, Jin-Jing; Jia, Hong-Li; Yu, Jie-Hui; Xu, Ji-Qing
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	23
Pages of publication	8162
a	10.346 ± 0.002 Å
b	11.139 ± 0.002 Å
c	13.478 ± 0.003 Å
α	66.01 ± 0.03°
β	84.96 ± 0.03°
γ	76.27 ± 0.03°
Cell volume	1378.5 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0364
Residual factor for significantly intense reflections	0.0321
Weighted residual factors for significantly intense reflections	0.0958
Weighted residual factors for all reflections included in the refinement	0.1032
Goodness-of-fit parameter for all reflections included in the refinement	1.198
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
180480 (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 7/21/49.	7214917.cif
110995	2014-04-20	cif/ Adding structures of 7214915, 7214916, 7214917, 7214918 via cif-deposit CGI script.	7214917.cif