Crystallography Open Database

Information card for entry 8106831

Preview

Coordinates	8106831.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C82 H64 Co2 N12 O11
Calculated formula	C82 H62 Co2 N12 O11
Title of publication	Crystal structure of poly[diaquabis(μ2-biphenyl-2,4′-dicarboxylato-κ2 O:O′)tris(μ2-1,1′-biphenyl-4,4′-diylbis(1H-imidazole)-κ2 N:N′)dicobalt(II)] monohydrat, C82H64N12O11Co2
Authors of publication	Zi, Wang; Guo-Wang, Xu; Hai-Bin, Wang; Zhi-Hang, Zhou; Dong-Sheng, Li
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2016
Journal volume	231
Journal issue	1
Pages of publication	219 - 221
a	22.286 ± 0.007 Å
b	22.725 ± 0.007 Å
c	14.056 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	7119 ± 4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.085
Residual factor for significantly intense reflections	0.0582
Weighted residual factors for significantly intense reflections	0.1445
Weighted residual factors for all reflections included in the refinement	0.1634
Goodness-of-fit parameter for all reflections included in the refinement	1.061
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
281651 (current)	2023-03-06	cif/ Adding structures of 8106831 via cif-deposit CGI script.	8106831.cif