Crystallography Open Database

Information card for entry 7239861

Preview

Coordinates	7239861.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10.8 H7.2 Co0.4 N0.8 O3.2 S0.4
Calculated formula	C10.8 H6.4 Co0.4 N0.8 O3.2 S0.4
Title of publication	Assembly of four new cobalt coordination polymers modulated by N-coligands: sensitive and selective sensing of nitroaromatics, Fe3+ and Cr2O72− in water
Authors of publication	Tu, Qian-Qian; Ren, Ling-Ling; Cui, Ying-Ying; Cheng, Ai-Ling; Gao, En-Qing
Journal of publication	CrystEngComm
Year of publication	2020
Journal volume	22
Journal issue	10
Pages of publication	1789 - 1801
a	7.4557 ± 0.0003 Å
b	12.6096 ± 0.0005 Å
c	13.7586 ± 0.0003 Å
α	94.478 ± 0.003°
β	98.662 ± 0.003°
γ	101.166 ± 0.003°
Cell volume	1246.84 ± 0.08 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	0.0534
Residual factor for significantly intense reflections	0.0466
Weighted residual factors for significantly intense reflections	0.1213
Weighted residual factors for all reflections included in the refinement	0.1255
Goodness-of-fit parameter for all reflections included in the refinement	1.03
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
257430 (current)	2020-10-06	cif/ Updating files of 7239861, 7239862, 7239863, 7239864 Original log message: Adding full bibliography for 7239861--7239864.cif.	7239861.cif
250263	2020-04-05	cif/ Updating files of 7239861, 7239862, 7239863, 7239864 Original log message: Adding full bibliography for 7239861--7239864.cif.	7239861.cif
247512	2020-02-04	cif/ Adding structures of 7239861, 7239862, 7239863, 7239864 via cif-deposit CGI script.	7239861.cif