Crystallography Open Database

Information card for entry 7218816

Preview

Coordinates	7218816.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C4 H16 Ge Mn2 N4 S4
Calculated formula	C4 H16 Ge Mn2 N4 S4
Title of publication	[Mn(dien)2]MnSnS4, [Mn(1,2-dap)]2Sn2S6and [Mn(en)2]MnGeS4: from 1D anionic and neutral chains to 3D neutral frameworks
Authors of publication	Yue, Cheng-Yang; Lei, Xiao-Wu; Yin, Ling; Zhai, Xiu-Rong; Ba, Zhong-Ren; Niu, Yan-Qiang; Li, Yue-Peng
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	4
Pages of publication	814
a	14.2744 ± 0.0015 Å
b	7.8786 ± 0.0009 Å
c	12.4054 ± 0.0013 Å
α	90°
β	90°
γ	90°
Cell volume	1395.1 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	56
Hermann-Mauguin space group symbol	P c c n
Hall space group symbol	-P 2ab 2ac
Residual factor for all reflections	0.0382
Residual factor for significantly intense reflections	0.0246
Weighted residual factors for significantly intense reflections	0.0598
Weighted residual factors for all reflections included in the refinement	0.0663
Goodness-of-fit parameter for all reflections included in the refinement	1.037
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
180519 (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 7/21/88.	7218816.cif
133153	2015-03-06	cif/ Updating files of 7218816, 7218817, 7218818 Original log message: Adding full bibliography for 7218816--7218818.cif.	7218816.cif
127537	2014-11-20	cif/ Adding structures of 7218816, 7218817, 7218818 via cif-deposit CGI script.	7218816.cif