Crystallography Open Database

Information card for entry 7022135

Preview

Coordinates	7022135.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H17 Cd O9
Calculated formula	C28 H17 Cd O9
Title of publication	A new three-dimensional metal-organic framework constructed from 9,10-anthracene dibenzoate and Cd(II) as a highly active heterogeneous catalyst for oxidation of alkylbenzenes.
Authors of publication	Shi, Dabin; Ren, Yanwei; Jiang, Huanfeng; Lu, Jiaxian; Cheng, Xiaofei
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2013
Journal volume	42
Journal issue	2
Pages of publication	484 - 491
a	33.321 ± 0.007 Å
b	9.807 ± 0.002 Å
c	7.8951 ± 0.0016 Å
α	90°
β	96.68 ± 0.03°
γ	90°
Cell volume	2562.4 ± 0.9 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
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	0.0637
Residual factor for significantly intense reflections	0.041
Weighted residual factors for significantly intense reflections	0.0924
Weighted residual factors for all reflections included in the refinement	0.1234
Goodness-of-fit parameter for all reflections included in the refinement	1.128
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179926 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/21.	7022135.cif
89987	2013-11-17	cif/ Adding structures of 7022135 via cif-deposit CGI script.	7022135.cif