Crystallography Open Database

Information card for entry 7063004

Preview

Coordinates	7063004.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H32 Cl2 Cu2 N6 O2
Calculated formula	C40 H32 Cl2 Cu2 N6 O2
Title of publication	Investigation on chloro-bridged binuclear copper(ii) complexes as potent metallodrug candidates against colon cancer via chemical and biological assessments
Authors of publication	Sankar, Neethu; Devarajan, Badhmapriya; Manimuthu, Akilesh; Nattamai S. P., Bhuvanesh; Nallasamy, Dharmaraj; Velusamy, Kaveri Machampalayam
Journal of publication	New Journal of Chemistry
Year of publication	2024
Journal volume	48
Journal issue	8
Pages of publication	3741 - 3757
a	11.5354 ± 0.0004 Å
b	12.0272 ± 0.0004 Å
c	12.4998 ± 0.0004 Å
α	90°
β	93.604 ± 0.002°
γ	90°
Cell volume	1730.77 ± 0.1 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.075
Residual factor for significantly intense reflections	0.0668
Weighted residual factors for significantly intense reflections	0.1665
Weighted residual factors for all reflections included in the refinement	0.176
Goodness-of-fit parameter for all reflections included in the refinement	1.069
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
290227 (current)	2024-03-04	cif/ Updating files of 7063003, 7063004, 7063005, 7063006, 7063007 Original log message: Adding full bibliography for 7063003--7063007.cif.	7063004.cif
289717	2024-02-06	cif/ Adding structures of 7063003, 7063004, 7063005, 7063006, 7063007 via cif-deposit CGI script.	7063004.cif