Crystallography Open Database

Information card for entry 7206747

7206746 << 7206747 >> 7206748

Preview

Coordinates	7206747.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H82 Mn6 N8 O51
Calculated formula	C60 H28 Mn6 N8 O51
Title of publication	Three porous metal‒organic frameworks based on an azobenzenetricarboxylate ligand: synthesis, structures, and magnetic properties
Authors of publication	Meng, Miao; Zhong, Di-Chang; Lu, Tong-Bu
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	22
Pages of publication	6794
a	30.3206 ± 0.0018 Å
b	7.247 ± 0.0003 Å
c	19.337 ± 0.0009 Å
α	90°
β	106.844 ± 0.002°
γ	90°
Cell volume	4066.7 ± 0.4 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	5
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.08
Residual factor for significantly intense reflections	0.0519
Weighted residual factors for significantly intense reflections	0.1312
Weighted residual factors for all reflections included in the refinement	0.1813
Goodness-of-fit parameter for all reflections included in the refinement	1.076
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
180398 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/67.	7206747.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7206747.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7206747.cif
29999	2011-11-09	../uploads/cif-deposit/cod/cif Adding structures of 7206745, 7206746, 7206747 via cif-deposit CGI script.	7206747.cif