Crystallography Open Database

Information card for entry 7225079

Preview

Coordinates	7225079.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H18 Co3 N4 O10
Calculated formula	C24 H18 Co3 N4 O10
Title of publication	A CoII-based metal‒organic framework based on [Co6(μ3-OH)4] units exhibiting selective sorption of C2H2over CO2and CH4
Authors of publication	Chen, Di-Ming; Tian, Jia-Yue; Liu, Chun-Sen; Du, Miao
Journal of publication	CrystEngComm
Year of publication	2016
Journal volume	18
Journal issue	21
Pages of publication	3760
a	9.2607 ± 0.0002 Å
b	12.0677 ± 0.0003 Å
c	31.0183 ± 0.0007 Å
α	90°
β	97.604 ± 0.003°
γ	90°
Cell volume	3435.98 ± 0.14 Å³
Cell temperature	285.9 ± 0.6 K
Ambient diffraction temperature	285.9 ± 0.6 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0836
Residual factor for significantly intense reflections	0.0582
Weighted residual factors for significantly intense reflections	0.1905
Weighted residual factors for all reflections included in the refinement	0.2157
Goodness-of-fit parameter for all reflections included in the refinement	1.094
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
185244 (current)	2016-08-07	cif/ Updating files of 7225079 Original log message: Adding full bibliography for 7225079.cif.	7225079.cif
182460	2016-05-04	cif/ Adding structures of 7225079 via cif-deposit CGI script.	7225079.cif