Crystallography Open Database

Information card for entry 7024270

Preview

Coordinates	7024270.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	(Cu4(O)(L2)2(CH3COO)4)
Formula	C36 H45 Cl4 Cu4 N5 O11
Calculated formula	C32.5 H36 Cl4 Cu4 N5 O9.25
Title of publication	Tetranuclear copper(ii)-Schiff-base complexes as active catalysts for oxidation of cyclohexane and toluene.
Authors of publication	Roy, Partha; Manassero, Mario
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	6
Pages of publication	1539 - 1545
a	12.3084 ± 0.0006 Å
b	12.3084 Å
c	33.3164 ± 0.0017 Å
α	90°
β	90°
γ	90°
Cell volume	5047.3 ± 0.4 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	6
Space group number	88
Hermann-Mauguin space group symbol	I 41/a :2
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.072
Residual factor for significantly intense reflections	0.072
Weighted residual factors for significantly intense reflections	0.117
Goodness-of-fit parameter for all reflections	1.064
Goodness-of-fit parameter for significantly intense reflections	1.064
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	Mo-Kα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179947 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/42.	7024270.cif
92331	2014-01-12	cif/ Adding structures of 7024270 via cif-deposit CGI script.	7024270.cif