Crystallography Open Database

Information card for entry 4308180

Preview

Coordinates	4308180.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H34 Cl4 Cu2 N8 O12
Calculated formula	C22 H34 Cl4 Cu2 N8 O12
Title of publication	A New Branched Phenanthroline Derivative Ligand: Synthesis, Solution Chemistry, and Crystal Structures of Copper(II) and Zinc(II) 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	4737 - 4748
a	17.493 ± 0.006 Å
b	10.969 ± 0.004 Å
c	18.647 ± 0.005 Å
α	90°
β	114.08 ± 0.03°
γ	90°
Cell volume	3267 ± 2 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/a 1
Hall space group symbol	-P 2yab
Residual factor for all reflections	0.1397
Residual factor for significantly intense reflections	0.0971
Weighted residual factors for significantly intense reflections	0.2161
Weighted residual factors for all reflections included in the refinement	0.2483
Goodness-of-fit parameter for all reflections included in the refinement	1.076
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179119 (current)	2016-03-22	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/81.	4308180.cif
120081	2014-07-11	Adding DOIs to range 4/30 structures.	4308180.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4308180.cif
1194	2010-06-06	cif/4/ Adding data from Inorg-Chem-2007_01-13/ processing directory.	4308180.cif