Crystallography Open Database

Information card for entry 7210298

Preview

Coordinates	7210298.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H25 Mn2 N3 O11 S2
Calculated formula	C24 H25 Mn2 N3 O11 S2
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	9.4155 ± 0.0006 Å
b	9.9399 ± 0.0004 Å
c	15.3997 ± 0.0008 Å
α	82.238 ± 0.007°
β	86.946 ± 0.007°
γ	88.633 ± 0.008°
Cell volume	1425.81 ± 0.13 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0802
Residual factor for significantly intense reflections	0.0563
Weighted residual factors for significantly intense reflections	0.1467
Weighted residual factors for all reflections included in the refinement	0.1746
Goodness-of-fit parameter for all reflections included in the refinement	0.933
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
180433 (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 7/21/02.	7210298.cif
87591	2013-08-27	cif/ Adding structures of 7210298, 7210299, 7210300, 7210301 via cif-deposit CGI script.	7210298.cif