Crystallography Open Database

Information card for entry 7054025

Preview

Coordinates	7054025.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H46 Cu4 N16 O23
Calculated formula	C36 H44 Cu4 N16 O23
Title of publication	Effect of N-donor ancillary ligands on structural and magnetic properties of oxalate copper(ii) complexes
Authors of publication	Świtlicka-Olszewska, Anna; Machura, Barbara; Mroziński, Jerzy; Kalińska, Bożena; Kruszynski, Rafał; Penkala, Mateusz
Journal of publication	New Journal of Chemistry
Year of publication	2014
Journal volume	38
Journal issue	4
Pages of publication	1611
a	9.1374 ± 0.0006 Å
b	11.7993 ± 0.0007 Å
c	12.279 ± 0.0006 Å
α	87.214 ± 0.004°
β	85.536 ± 0.005°
γ	75.414 ± 0.005°
Cell volume	1276.73 ± 0.13 Å³
Cell temperature	295 ± 0.2 K
Ambient diffraction temperature	295 ± 0.2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0547
Residual factor for significantly intense reflections	0.0397
Weighted residual factors for significantly intense reflections	0.1212
Weighted residual factors for all reflections included in the refinement	0.1426
Goodness-of-fit parameter for all reflections included in the refinement	1.171
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
180094 (current)	2016-03-26	cif/7/05/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/05/40.	7054025.cif
108353	2014-03-30	cif/ Adding structures of 7054020, 7054021, 7054022, 7054023, 7054024, 7054025, 7054026, 7054027, 7054028 via cif-deposit CGI script.	7054025.cif