Crystallography Open Database

Information card for entry 4511101

Preview

Coordinates	4511101.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H12 Mn2 O10
Calculated formula	C10 H12 Mn2 O10
Title of publication	Coordination Chemistry of Cyclohexane-1,2,4,5-tetracarboxylate (H4L). Synthesis, Structure, and Magnetic Properties of Metal-Organic Frameworks with Conformation-Flexible H4L Ligand
Authors of publication	Wang, Jing; Ou, Yong-Cong; Shen, Yong; Yun, Lei; Leng, Ji-Dong; Lin, Zhuojia; Tong, Ming-Liang
Journal of publication	Crystal Growth & Design
Year of publication	2009
Journal volume	9
Journal issue	5
Pages of publication	2442
a	7.6071 ± 0.0002 Å
b	14.6486 ± 0.0003 Å
c	11.1213 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	1239.28 ± 0.05 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
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	0.154
Residual factor for significantly intense reflections	0.1302
Weighted residual factors for significantly intense reflections	0.3195
Weighted residual factors for all reflections included in the refinement	0.3386
Goodness-of-fit parameter for all reflections included in the refinement	1.071
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179658 (current)	2016-03-24	cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/11.	4511101.cif
114704	2014-05-29	cif/ Adding structures of 4511100, 4511101, 4511102, 4511103 via cif-deposit CGI script.	4511101.cif