Crystallography Open Database

Information card for entry 7214585

Preview

Coordinates	7214585.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C65 H42 Mn2 N8 O11
Calculated formula	C65 H42 Mn2 N8 O11
Title of publication	Coordination polymers based on 3,3′,4,4′-benzophenone-tetracarboxylate and N-containing pillars: syntheses, structure, characterization and properties
Authors of publication	Yang, Li-Rong; Zhang, Huai-Min; You, Qian-qian; Wu, Lan-Zhi; Liu, Liu; Song, Shuang
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	37
Pages of publication	7505
a	24.46 ± 0.004 Å
b	9.9842 ± 0.0014 Å
c	23.479 ± 0.003 Å
α	90°
β	110.705 ± 0.003°
γ	90°
Cell volume	5363.6 ± 1.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0602
Residual factor for significantly intense reflections	0.0441
Weighted residual factors for significantly intense reflections	0.1279
Weighted residual factors for all reflections included in the refinement	0.1355
Goodness-of-fit parameter for all reflections included in the refinement	1.073
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
180476 (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 7/21/45.	7214585.cif
110313	2014-04-18	cif/ Adding structures of 7214585, 7214586, 7214587 via cif-deposit CGI script.	7214585.cif