Crystallography Open Database

Information card for entry 4507652

Preview

Coordinates	4507652.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C67 H70 Cd3 N6 O23
Calculated formula	C67 H70 Cd3 N6 O23
Title of publication	Syntheses, Structures, Photochemical and Magnetic Properties of Novel Divalent Cd/Mn Coordination Polymers Based on a Semirigid Tripodal Carboxylate Ligand
Authors of publication	Cui, Jiehu; Yang, Qingxiang; Li, Yizhi; Guo, Zijian; Zheng, Hegen
Journal of publication	Crystal Growth & Design
Year of publication	2013
Journal volume	13
Journal issue	4
Pages of publication	1694
a	36.68 ± 0.015 Å
b	5.819 ± 0.002 Å
c	33.079 ± 0.014 Å
α	90°
β	90°
γ	90°
Cell volume	7060 ± 5 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	5
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.049
Residual factor for significantly intense reflections	0.0429
Weighted residual factors for significantly intense reflections	0.104
Weighted residual factors for all reflections included in the refinement	0.1066
Goodness-of-fit parameter for all reflections included in the refinement	1.017
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
179612 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/76.	4507652.cif
85604	2013-05-07	cif/ Adding structures of 4507650, 4507651, 4507652, 4507653, 4507654 via cif-deposit CGI script.	4507652.cif