Crystallography Open Database

Information card for entry 7221741

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Coordinates	7221741.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C51 H43 Co7 O43.5
Calculated formula	C51 H15 Co7 O43.5
Title of publication	[Co(H2O)6]2+and H3O+encapsulated in a unique 3D anionic Co(ii) framework with hydrophilic hexagonal and circular channels
Authors of publication	Zhao, Jun; Liu, Bo; Wu, Ya-Pan; Bai, Liang; Zhang, Jian; Li, Dong-Sheng
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	37
Pages of publication	7034
a	16.2712 ± 0.0004 Å
b	16.2712 ± 0.0004 Å
c	17.2772 ± 0.0008 Å
α	90°
β	90°
γ	120°
Cell volume	3961.3 ± 0.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	159
Hermann-Mauguin space group symbol	P 3 1 c
Hall space group symbol	P 3 -2c
Residual factor for all reflections	0.0538
Residual factor for significantly intense reflections	0.0534
Weighted residual factors for significantly intense reflections	0.1566
Weighted residual factors for all reflections included in the refinement	0.1572
Goodness-of-fit parameter for all reflections included in the refinement	1.049
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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