Crystallography Open Database

Information card for entry 4102169

Preview

Coordinates	4102169.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C168 H222 Cl4 Mn25 N15 O112
Calculated formula	C168 H222 Cl4 Mn25 N15 O112
Title of publication	Nanoscale Homochiral C3-Symmetric Mixed-Valence Manganese Cluster Complexes with Both Ferromagnetic and Ferroelectric Properties
Authors of publication	Cai-Ming Liu; Ren-Gen Xiong; De-Qing Zhang; Dao-Ben Zhu
Journal of publication	Journal of the American Chemical Society
Year of publication	2010
Journal volume	132
Pages of publication	4044 - 4045
a	26.847 ± 0.004 Å
b	26.847 ± 0.004 Å
c	33.221 ± 0.007 Å
α	90°
β	90°
γ	120°
Cell volume	20736 ± 6 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	146
Hermann-Mauguin space group symbol	R 3 :H
Hall space group symbol	R 3
Residual factor for all reflections	0.08
Residual factor for significantly intense reflections	0.0743
Weighted residual factors for significantly intense reflections	0.2139
Weighted residual factors for all reflections included in the refinement	0.2206
Goodness-of-fit parameter for all reflections included in the refinement	1.101
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
178767 (current)	2016-03-21	cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/21.	4102169.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4102169.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4102169.cif
25020	2011-09-08	../uploads/cif-deposit/cod/cif Adding structures of 4102169 via cif-deposit CGI script.	4102169.cif