Crystallography Open Database

Information card for entry 4330445

Preview

Coordinates	4330445.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H43 Cl Cu2 N4 O7
Calculated formula	C26 H43 Cl Cu2 N4 O7
Title of publication	Insertion of a Hydroxido Bridge into a Diphenoxido Dinuclear Copper(II) Complex: Drastic Change of the Magnetic Property from Strong Antiferromagnetic to Ferromagnetic and Enhancement in the Catecholase Activity
Authors of publication	Apurba Biswas; Lakshmi Kanta Das; Michael G. B. Drew; Carmen Diaz; Ashutosh Ghosh
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	10111 - 10121
a	12.912 ± 0.004 Å
b	13.044 ± 0.004 Å
c	19.528 ± 0.006 Å
α	81.778 ± 0.004°
β	84.012 ± 0.004°
γ	89.282 ± 0.004°
Cell volume	3237.4 ± 1.7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.109
Residual factor for significantly intense reflections	0.0682
Weighted residual factors for significantly intense reflections	0.1997
Weighted residual factors for all reflections included in the refinement	0.2228
Goodness-of-fit parameter for all reflections included in the refinement	1.062
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
179407 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/04.	4330445.cif
79714	2013-04-05	cif/ Adding structures of 4330445 via cif-deposit CGI script.	4330445.cif