Crystallography Open Database

Information card for entry 7219214

7219213 << 7219214 >> 7219215

Preview

Coordinates	7219214.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C3 H5 Cu N4 S
Calculated formula	C3 H5 Cu N4 S
Title of publication	Crystal engineering towards the luminescence property trimming of hybrid coordination polymers
Authors of publication	Liu, Beibei; Bai, Liang; Lin, Xiaoling; Li, Kaixuan; Huang, Hui; Hu, Hailiang; Liu, Yang; Kang, Zhenhui
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	7
Pages of publication	1686
a	8.7795 ± 0.0014 Å
b	6.4704 ± 0.0011 Å
c	10.8283 ± 0.0017 Å
α	90°
β	106.422 ± 0.002°
γ	90°
Cell volume	590.03 ± 0.17 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 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	0.0303
Residual factor for significantly intense reflections	0.0266
Weighted residual factors for significantly intense reflections	0.0666
Weighted residual factors for all reflections included in the refinement	0.0684
Goodness-of-fit parameter for all reflections included in the refinement	1.066
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
180523 (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 7/21/92.	7219214.cif
133166	2015-03-06	cif/ Updating files of 7219212, 7219213, 7219214, 7219215 Original log message: Adding full bibliography for 7219212--7219215.cif.	7219214.cif
129405	2015-01-07	cif/ Adding structures of 7219212, 7219213, 7219214, 7219215 via cif-deposit CGI script.	7219214.cif