Crystallography Open Database

Information card for entry 4501935

4501934 << 4501935 >> 4501936

Preview

Coordinates	4501935.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H16 Mn2 N4 O10
Calculated formula	C22 H16 Mn2 N4 O10
Title of publication	One Chiral and Two Achiral 3-D Coordination Polymers Constructed by 2-Phenyl Imidazole Dicarboxylate
Authors of publication	Wang, Wenyue; Niu, Xiling; Gao, Yongchao; Zhu, Yanyan; Li, Gang; Lu, Huijie; Tang, Mingsheng
Journal of publication	Crystal Growth & Design
Year of publication	2010
Journal volume	10
Journal issue	9
Pages of publication	4050
a	28.5972 ± 0.0006 Å
b	28.5972 ± 0.0006 Å
c	8.7442 ± 0.0005 Å
α	90°
β	90°
γ	120°
Cell volume	6193 ± 0.4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	161
Hermann-Mauguin space group symbol	R 3 c :H
Hall space group symbol	R 3 -2"c
Residual factor for all reflections	0.1059
Residual factor for significantly intense reflections	0.0515
Weighted residual factors for significantly intense reflections	0.0706
Weighted residual factors for all reflections included in the refinement	0.0767
Goodness-of-fit parameter for all reflections included in the refinement	0.879
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
179550 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/19.	4501935.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4501935.cif
36170	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 4501935 via cif-deposit CGI script.	4501935.cif