Crystallography Open Database

Information card for entry 4306991

Preview

Coordinates	4306991.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H38 Cl2 N6 O12 Zn2
Calculated formula	C22 H34 Cl2 N6 O12 Zn2
Title of publication	Modulating the M-M Distance in Dinuclear Complexes. New Ligand with a 2,2'-Biphenol Fragment as Key Unit: Synthesis, Coordination Behavior, and Crystal Structures of Cu(II) and Zn(II) Dinuclear Complexes
Authors of publication	Gianluca Ambrosi; Mauro Formica; Vieri Fusi; Luca Giorgi; Annalisa Guerri; Mauro Micheloni; Paola Paoli; Roberto Pontellini; Patrizia Rossi
Journal of publication	Inorganic Chemistry
Year of publication	2007
Journal volume	46
Pages of publication	309 - 320
a	10.955 ± 0.001 Å
b	14.075 ± 0.001 Å
c	40.522 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	6248.2 ± 1 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.1591
Residual factor for significantly intense reflections	0.0777
Weighted residual factors for significantly intense reflections	0.1974
Weighted residual factors for all reflections included in the refinement	0.2545
Goodness-of-fit parameter for all reflections included in the refinement	0.895
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179107 (current)	2016-03-23	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/69.	4306991.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4306991.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4306991.cif
1194	2010-06-06	cif/4/ Adding data from Inorg-Chem-2007_01-13/ processing directory.	4306991.cif