Crystallography Open Database

Information card for entry 7210300

Preview

Coordinates	7210300.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H11 Mn N O5 S
Calculated formula	C10 H11 Mn N O5 S
Title of publication	Solvent controlled assembly of four Mn(ii)-2,5-thiophenedicarboxylate frameworks with rod-packing architectures and magnetic properties
Authors of publication	Tan, Yan-Xi; He, Yan-Ping; Zhang, Ying; Zheng, Yan-Jun; Zhang, Jian
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	30
Pages of publication	6009
a	11.857 ± 0.009 Å
b	18.273 ± 0.013 Å
c	11.496 ± 0.011 Å
α	90°
β	99.2 ± 0.02°
γ	90°
Cell volume	2459 ± 3 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	0.0884
Residual factor for significantly intense reflections	0.0602
Weighted residual factors for significantly intense reflections	0.1539
Weighted residual factors for all reflections included in the refinement	0.234
Goodness-of-fit parameter for all reflections included in the refinement	1.17
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
180434 (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 7/21/03.	7210300.cif
87591	2013-08-27	cif/ Adding structures of 7210298, 7210299, 7210300, 7210301 via cif-deposit CGI script.	7210300.cif