Crystallography Open Database

Information card for entry 4501589

Preview

Coordinates	4501589.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C H5.5 Mn2 N5 O6.25 S
Calculated formula	C H6 Mn2 N5 O6.25 S
Title of publication	Syntheses, Crystal Structures, and Magnetic Properties of Two Mn(II) Coordination Polymers Based on the 5-Aminotetrazole Ligand: Effect of Sources of Ligand on Construction of Topological Networks
Authors of publication	Wang, Tian-Wei; Liu, Dong-Sheng; Huang, Chang-Cang; Sui, Yan; Huang, Xi-He; Chen, Jian-Zhong; You, Xiao-Zeng
Journal of publication	Crystal Growth & Design
Year of publication	2010
Journal volume	10
Journal issue	8
Pages of publication	3429
a	9.24 ± 0.0018 Å
b	6.9128 ± 0.0014 Å
c	16.095 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	1028.1 ± 0.3 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
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	0.0379
Residual factor for significantly intense reflections	0.0375
Weighted residual factors for significantly intense reflections	0.1271
Weighted residual factors for all reflections included in the refinement	0.1279
Goodness-of-fit parameter for all reflections included in the refinement	1.093
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
179546 (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 4/50/15.	4501589.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4501589.cif
35978	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 4501589 via cif-deposit CGI script.	4501589.cif