Crystallography Open Database

Information card for entry 7224124

Preview

Coordinates	7224124.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	C41H41.99B2CoF8N12
Formula	C41 H41.99 B2 Co F8 N12
Calculated formula	C40.9975 H41.995 B2 Co F8 N12
Title of publication	Syntheses, structures, and magnetic properties of three new chain compounds based on a pentagonal bipyramidal Co(ii) building block
Authors of publication	Shao, Dong; Shi, Le; Zhang, Shao-Liang; Zhao, Xin-Hua; Wu, Dong-Qing; Wei, Xiao-Qin; Wang, Xin-Yi
Journal of publication	CrystEngComm
Year of publication	2016
Journal volume	18
Journal issue	22
Pages of publication	4150
a	13.8571 ± 0.0007 Å
b	16.6586 ± 0.0008 Å
c	19.6933 ± 0.0009 Å
α	68.138 ± 0.001°
β	88.062 ± 0.002°
γ	88.016 ± 0.002°
Cell volume	4215.5 ± 0.4 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 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	0.1144
Residual factor for significantly intense reflections	0.0757
Weighted residual factors for significantly intense reflections	0.1654
Weighted residual factors for all reflections included in the refinement	0.1812
Goodness-of-fit parameter for all reflections included in the refinement	1.08
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
185166 (current)	2016-08-07	cif/ Updating files of 7224123, 7224124, 7224125 Original log message: Adding full bibliography for 7224123--7224125.cif.	7224124.cif
175722	2016-02-04	cif/ Adding structures of 7224123, 7224124, 7224125 via cif-deposit CGI script.	7224124.cif