Crystallography Open Database

Information card for entry 7239727

Preview

Coordinates	7239727.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H46 Co3 N12 O16 S2
Calculated formula	C52 H46 Co3 N12 O16 S2
Title of publication	Functional group induced structural diversities and photocatalytic, magnetic and luminescence sensing properties of four cobalt(ii) coordination polymers based on 1,3,5-tris(2-methylimidazol-1-yl)benzene
Authors of publication	Wang, Jun; Chen, Ning-Ning; Zhang, Chen; Jia, Li-Yong; Fan, Liming
Journal of publication	CrystEngComm
Year of publication	2020
Journal volume	22
Journal issue	4
Pages of publication	811 - 820
a	19.47 ± 0.003 Å
b	11.53 ± 0.015 Å
c	29.73 ± 0.004 Å
α	90°
β	107.15 ± 0.009°
γ	90°
Cell volume	6377 ± 8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	I 1 2/a 1
Hall space group symbol	-I 2ya
Residual factor for all reflections	0.0953
Residual factor for significantly intense reflections	0.0803
Weighted residual factors for significantly intense reflections	0.1981
Weighted residual factors for all reflections included in the refinement	0.2053
Goodness-of-fit parameter for all reflections included in the refinement	1.174
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
257453 (current)	2020-10-06	cif/ Updating files of 7239726, 7239727, 7239728, 7239729 Original log message: Adding full bibliography for 7239726--7239729.cif.	7239727.cif
247665	2020-02-04	cif/ Updating files of 7239726, 7239727, 7239728, 7239729 Original log message: Adding full bibliography for 7239726--7239729.cif.	7239727.cif
246521	2020-01-04	cif/ Adding structures of 7239726, 7239727, 7239728, 7239729 via cif-deposit CGI script.	7239727.cif