Crystallography Open Database

Information card for entry 7019110

7019109 << 7019110 >> 7019111

Preview

Coordinates	7019110.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H20 Cu N4 O2
Calculated formula	C18 H20 Cu N4 O2
SMILES	[Cu]123N(C(=O)[C@@H]([NH2]1)c1ccccc1)CCN2C(=O)[C@@H]([NH2]3)c1ccccc1
Title of publication	Copper(ii) complexes of bis(amino amide) ligands: effect of changes in the amino acid residue.
Authors of publication	Martí, Inés; Ferrer, Armando; Escorihuela, Jorge; Burguete, M. Isabel; Luis, Santiago V.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2012
Journal volume	41
Journal issue	22
Pages of publication	6764 - 6776
a	10.4048 ± 0.0011 Å
b	11.3542 ± 0.0013 Å
c	14.9983 ± 0.0018 Å
α	90°
β	90°
γ	90°
Cell volume	1771.9 ± 0.3 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 K
Number of distinct elements	5
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.1022
Residual factor for significantly intense reflections	0.05
Weighted residual factors for significantly intense reflections	0.104
Weighted residual factors for all reflections included in the refinement	0.1244
Goodness-of-fit parameter for all reflections included in the refinement	1.017
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
179895 (current)	2016-03-25	cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/91.	7019110.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7019110.cif
60441	2012-06-14	cif/ Adding structures of 7019110, 7019111 via cif-deposit CGI script.	7019110.cif