Crystallography Open Database

Information card for entry 7108411

Preview

Coordinates	7108411.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H11 Cu2 N3 O11
Calculated formula	C23 H11 Cu2 N3 O11
Title of publication	A versatile metal-organic framework for carbon dioxide capture and cooperative catalysis
Authors of publication	Jinhee Park; Jian-Rong Li; Ying-Pin Chen; Linbing Sun; Hong-Cai Zhou
Journal of publication	Chem.Commun.
Year of publication	2012
Journal volume	48
Pages of publication	9995
a	30.585 ± 0.012 Å
b	30.585 ± 0.012 Å
c	30.585 ± 0.012 Å
α	90°
β	90°
γ	90°
Cell volume	28611 ± 19 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	5
Space group number	229
Hermann-Mauguin space group symbol	I m -3 m
Hall space group symbol	-I 4 2 3
Residual factor for all reflections	0.1186
Residual factor for significantly intense reflections	0.0914
Weighted residual factors for significantly intense reflections	0.1966
Weighted residual factors for all reflections included in the refinement	0.2125
Goodness-of-fit parameter for all reflections included in the refinement	1.029
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7108411.html