Crystallography Open Database

Information card for entry 7214533

Preview

Coordinates	7214533.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26.4 H24.2 Co N2 O7.1
Calculated formula	C26.4 H22 Co N2 O7.1
Title of publication	Methanol mediated crystal transformations in a solvatochromic metal organic framework constructed from Co(ii) and 4-(4-pyridyl) benzoate
Authors of publication	Mehlana, Gift; Ramon, Gaëlle; Bourne, Susan A.
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	45
Pages of publication	9521
a	10.7022 ± 0.0004 Å
b	10.7022 ± 0.0004 Å
c	22.8742 ± 0.0019 Å
α	90°
β	90°
γ	120°
Cell volume	2268.9 ± 0.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	145
Hermann-Mauguin space group symbol	P 32
Hall space group symbol	P 32
Residual factor for all reflections	0.1398
Residual factor for significantly intense reflections	0.1046
Weighted residual factors for significantly intense reflections	0.2944
Weighted residual factors for all reflections included in the refinement	0.3235
Goodness-of-fit parameter for all reflections included in the refinement	1.298
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
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.	7214533.cif
110295	2014-04-18	cif/ Adding structures of 7214531, 7214532, 7214533 via cif-deposit CGI script.	7214533.cif