Crystallography Open Database

Information card for entry 7219633

7219632 << 7219633 >> 7219634

Preview

Coordinates	7219633.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H16 Cl0.31 Cu4 N32 O4.69
Calculated formula	C24 H8 Cl0.27 Cu4 N32 O4.73
Title of publication	Solvent-Free Heterogeneous Catalysis for Cyanosilylation in a Modified Sodalite-typed Cu(II)-MOF
Authors of publication	Zhang, Lingjuan; Han, Cai-Yun; Dang, Qin-Qin; Wang, Yanhong; Zhang, Xian-Ming
Journal of publication	RSC Adv.
Year of publication	2015
a	18.6233 ± 0.0012 Å
b	18.6233 ± 0.0012 Å
c	18.6233 ± 0.0012 Å
α	90°
β	90°
γ	90°
Cell volume	6459.1 ± 0.7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	221
Hermann-Mauguin space group symbol	P m -3 m
Hall space group symbol	-P 4 2 3
Residual factor for all reflections	0.0857
Residual factor for significantly intense reflections	0.0705
Weighted residual factors for significantly intense reflections	0.2072
Weighted residual factors for all reflections included in the refinement	0.2205
Goodness-of-fit parameter for all reflections included in the refinement	1.056
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180527 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/96.	7219633.cif
132355	2015-02-24	cif/ Adding structures of 7219633 via cif-deposit CGI script.	7219633.cif