Crystallography Open Database

Information card for entry 7211876

Preview

Coordinates	7211876.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H24 O16 Pr2
Calculated formula	C22 H24 O16 Pr2
Title of publication	Synthesis, structure and luminescent properties of coordination polymers with 1,2-benzenedicarboxylic acid and a series of flexible dicarboxylate ligands
Authors of publication	Wang, Zhuo; Xing, Yong-Heng; Wang, Chun-Guang; Sun, Li-Xian; Zhang, Jian; Ge, Mao-Fa; Niu, Shu-Yun
Journal of publication	CrystEngComm
Year of publication	2010
Journal volume	12
Journal issue	3
Pages of publication	762
a	6.2994 ± 0.0013 Å
b	8.9181 ± 0.0018 Å
c	12.448 ± 0.003 Å
α	77.22 ± 0.03°
β	78.95 ± 0.03°
γ	71 ± 0.03°
Cell volume	639.4 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	1
Hermann-Mauguin space group symbol	P 1
Hall space group symbol	P 1
Residual factor for all reflections	0.0229
Residual factor for significantly intense reflections	0.0226
Weighted residual factors for significantly intense reflections	0.0577
Weighted residual factors for all reflections included in the refinement	0.058
Goodness-of-fit parameter for all reflections included in the refinement	1.061
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
180449 (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 7/21/18.	7211876.cif
92451	2014-01-12	cif/ Adding structures of 7211869, 7211870, 7211871, 7211872, 7211873, 7211874, 7211875, 7211876 via cif-deposit CGI script.	7211876.cif