Crystallography Open Database

Information card for entry 7205834

7205833 << 7205834 >> 7205835

Preview

Coordinates	7205834.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H60 Cl0 Mn4 N0 O20
Calculated formula	C50 H56 Mn4 O20
Title of publication	Two new ferrimagnetic MnII-carboxylate coordination polymers constructed from 5-tert-butyl isophthalic acid with (5/2, 15/2) and (5/2, 10/2) spin topologies
Authors of publication	Tian, Chong-Bin; He, Zhang-Zhen; Li, Zhi-Hua; Lin, Ping; Du, Shao-Wu
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	8
Pages of publication	3080
a	11.6608 ± 0.0006 Å
b	39.3981 ± 0.0019 Å
c	24.4617 ± 0.0012 Å
α	90°
β	101.297 ± 0.003°
γ	90°
Cell volume	11020.3 ± 1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
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	0.0628
Residual factor for significantly intense reflections	0.0574
Weighted residual factors for significantly intense reflections	0.1828
Weighted residual factors for all reflections included in the refinement	0.1885
Goodness-of-fit parameter for all reflections included in the refinement	0.991
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
180389 (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 7/20/58.	7205834.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7205834.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7205834.cif
21026	2011-06-21	../uploads/cif-deposit/cod/cif Adding structures of 7205834, 7205835 via cif-deposit CGI script.	7205834.cif