Crystallography Open Database

Information card for entry 7232020

7232019 << 7232020 >> 7232021

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Coordinates	7232020.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C108 H72 Co6 N18 O30
Calculated formula	C108 H72 Co6 N18 O30
Title of publication	Selective CO2 adsorption and theoretical simulation of a stable Co(ii)-based metal‒organic framework with tunable crystal size
Authors of publication	Qin, Bo-Wen; Zhou, Bao-Lei; Cui, Zheng; Zhou, Lei; Zhang, Xiao-Ying; Li, Wen-Liang; Zhang, Jing-Ping
Journal of publication	CrystEngComm
Year of publication	2019
Journal volume	21
Journal issue	10
Pages of publication	1564
a	39.377 Å
b	43.654 Å
c	38.551 Å
α	90°
β	90°
γ	90°
Cell volume	66267.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	43
Hermann-Mauguin space group symbol	F d d 2
Hall space group symbol	F 2 -2d
Residual factor for all reflections	0.0687
Residual factor for significantly intense reflections	0.0489
Weighted residual factors for significantly intense reflections	0.1344
Weighted residual factors for all reflections included in the refinement	0.1484
Goodness-of-fit parameter for all reflections included in the refinement	1.001
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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