Crystallography Open Database

Information card for entry 7249623

Preview

Coordinates	7249623.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H50 Cu3 N8 O12
Calculated formula	C42 H50 Cu3 N8 O12
Title of publication	Versatile copper(ii) discrete and polymeric coordination compounds with (pyridine-2-yl)methylenenicotinohydrazide and azelaic acid
Authors of publication	Benito, Mónica; Mahmoudi, Ghodrat; Molins, Elies; Zangrando, Ennio; Servati Gargari, Masoumeh; Gomila, Rosa M.; Frontera, Antonio; Safin, Damir A.
Journal of publication	CrystEngComm
Year of publication	2025
Journal volume	27
Journal issue	2
Pages of publication	164 - 175
a	10.201 ± 0.004 Å
b	10.349 ± 0.004 Å
c	11.762 ± 0.005 Å
α	86.291 ± 0.01°
β	74.948 ± 0.008°
γ	78.418 ± 0.009°
Cell volume	1174.6 ± 0.8 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 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	0.2009
Residual factor for significantly intense reflections	0.0992
Weighted residual factors for significantly intense reflections	0.2171
Weighted residual factors for all reflections included in the refinement	0.2669
Goodness-of-fit parameter for all reflections included in the refinement	1.056
Diffraction radiation probe	x-ray
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
298197 (current)	2025-03-04	cif/ Updating files of 7249623, 7249624, 7249625 Original log message: Adding full bibliography for 7249623--7249625.cif.	7249623.cif
296029	2024-11-21	cif/ Adding structures of 7249623, 7249624, 7249625 via cif-deposit CGI script.	7249623.cif