Crystallography Open Database

Information card for entry 7205950

7205949 << 7205950 >> 7205951

Preview

Coordinates	7205950.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H58 Br8 Cd3 N10 O13 S4
Calculated formula	C18 H48 Br8 Cd3 N10 O13 S4
Title of publication	New organically decorated cadmium halides incorporating the second or the third inorganic anionic groups
Authors of publication	Jin, Juan; Jia, Ming-Jun; Peng, Yu; Yu, Jie-Hui; Xu, Ji-Qing
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	8
Pages of publication	2942
a	27.198 ± 0.005 Å
b	13.261 ± 0.003 Å
c	13.222 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	4768.8 ± 1.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0558
Residual factor for significantly intense reflections	0.0435
Weighted residual factors for significantly intense reflections	0.1119
Weighted residual factors for all reflections included in the refinement	0.1167
Goodness-of-fit parameter for all reflections included in the refinement	1.035
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
180390 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/59.	7205950.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7205950.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7205950.cif
21294	2011-06-22	../uploads/cif-deposit/cod/cif Adding structures of 7205950, 7205951 via cif-deposit CGI script.	7205950.cif