Crystallography Open Database

Information card for entry 7212194

Preview

Coordinates	7212194.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Mn(M4)(dmf)]-1/2(DMF)
Formula	C18.5 H18.5 Mn N3.5 O6.5
Calculated formula	C18.5 H18.5 Mn N3.5 O6.5
Title of publication	Metal‒organic frameworks with pyridyl- and carboxylate-containing ligands: syntheses, structures and properties
Authors of publication	Chen, Man-Sheng; Bai, Zheng-Shuai; Okamura, Taka-aki; Su, Zhi; Chen, Shui-Sheng; Sun, Wei-Yin; Ueyama, Norikazu
Journal of publication	CrystEngComm
Year of publication	2010
Journal volume	12
Journal issue	6
Pages of publication	1935
a	18.733 ± 0.002 Å
b	10.2319 ± 0.0014 Å
c	20.283 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	3887.7 ± 0.9 Å³
Cell temperature	200 K
Ambient diffraction temperature	200 K
Number of distinct elements	5
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.0731
Residual factor for significantly intense reflections	0.0463
Weighted residual factors for significantly intense reflections	0.0987
Weighted residual factors for all reflections included in the refinement	0.1091
Goodness-of-fit parameter for all reflections included in the refinement	1.018
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7212194.cif
92701	2014-01-12	cif/ Adding structures of 7212194, 7212195, 7212196, 7212197, 7212198, 7212199 via cif-deposit CGI script.	7212194.cif