Crystallography Open Database

Information card for entry 7239862

Preview

Coordinates	7239862.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C9.29 H5.71 Co0.43 N0.57 O3 S0.43
Calculated formula	C9.28571 H5.28571 Co0.428571 N0.571429 O3 S0.428571
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	10.5883 ± 0.0004 Å
b	12.9921 ± 0.0005 Å
c	14.4442 ± 0.0005 Å
α	63.887 ± 0.004°
β	79.26 ± 0.003°
γ	79.327 ± 0.003°
Cell volume	1740.9 ± 0.13 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	0.1009
Residual factor for significantly intense reflections	0.0915
Weighted residual factors for significantly intense reflections	0.2145
Weighted residual factors for all reflections included in the refinement	0.2196
Goodness-of-fit parameter for all reflections included in the refinement	1.096
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.	7239862.cif
250263	2020-04-05	cif/ Updating files of 7239861, 7239862, 7239863, 7239864 Original log message: Adding full bibliography for 7239861--7239864.cif.	7239862.cif
247512	2020-02-04	cif/ Adding structures of 7239861, 7239862, 7239863, 7239864 via cif-deposit CGI script.	7239862.cif