Crystallography Open Database

Information card for entry 4030423

Preview

Coordinates	4030423.cif
External links	PubChem

Structure parameters

Formula	C18 H12 Cu N2 O2
Calculated formula	C18 H12 Cu N2 O2
SMILES	c1ccc2c3c1ccc[n]3[Cu]1(O2)[n]2cccc3cccc(c23)O1
Title of publication	Structure of the gamma' form of copper (II) quinolinolate and structural filiations to related M2+ complexes
Authors of publication	Ammor, S.; Coquerel, G.; Perez, G.; Robert, F.
Journal of publication	European Journal of Solid State and Inorganic Chemistry
Year of publication	1992
Journal volume	29
Pages of publication	445 - 453
a	10.213 ± 0.002 Å
b	5.075 ± 0.001 Å
c	15.325 ± 0.002 Å
α	90°
β	120.48 ± 0.02°
γ	90°
Cell volume	684.5 ± 0.3 Å³
Ambient diffraction temperature	293 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for significantly intense reflections	0.04
Diffraction radiation probe	x-ray
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
301828 (current)	2025-08-20	Add cross-references to PubChem compounds in COD range 4/03/ Each referenced PubChem compound corresponds to the full crystal structure.	4030423.cif
178483	2016-03-21	cif/4/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/03/04.	4030423.cif
129425	2015-01-07	cif/ Adding structures of 4030423 via cif-deposit CGI script.	4030423.cif