Crystallography Open Database

Information card for entry 7216234

Preview

Coordinates	7216234.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H4 Co8 K5 N36 O51
Calculated formula	C48 H4 Co8 K5 N36 O51
Title of publication	Alkaline cation directed structural diversity of cubic-cage-based cobalt(ii) metal‒organic frameworks: from pcu to bct net
Authors of publication	Zou, Ji-Yong; Shi, Wei; Zhang, Jing-Ya; He, Yan-Fei; Gao, Hong-Ling; Cui, Jian-Zhong; Cheng, Peng
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	30
Pages of publication	7133
a	28.9159 ± 0.0013 Å
b	18.0006 ± 0.0012 Å
c	28.5482 ± 0.0014 Å
α	90°
β	110.501 ± 0.005°
γ	90°
Cell volume	13918.3 ± 1.4 Å³
Cell temperature	126.1 ± 0.3 K
Ambient diffraction temperature	126.1 ± 0.3 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1219
Residual factor for significantly intense reflections	0.0785
Weighted residual factors for significantly intense reflections	0.227
Weighted residual factors for all reflections included in the refinement	0.2515
Goodness-of-fit parameter for all reflections included in the refinement	0.971
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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