Crystallography Open Database

Information card for entry 4515899

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Coordinates	4515899.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H36 Cl4 Cu2 N8 O12 Zn2
Calculated formula	C38 H36 Cl4 Cu2 N8 O12 Zn2
Title of publication	Bioactive Heterometallic Cu<sup>II</sup>-Zn<sup>II</sup> Complexes with Potential Biomedical Applications.
Authors of publication	Majumder, Ishani; Chakraborty, Prateeti; Álvarez, Raquel; Gonzalez-Diaz, Myriam; Peláez, Rafael; Ellahioui, Younes; Bauza, Antonio; Frontera, Antonio; Zangrando, Ennio; Gómez-Ruiz, Santiago; Das, Debasis
Journal of publication	ACS omega
Year of publication	2018
Journal volume	3
Journal issue	10
Pages of publication	13343 - 13353
a	10.08 ± 0.0004 Å
b	17.9664 ± 0.0008 Å
c	12.4991 ± 0.0006 Å
α	90°
β	96.773 ± 0.002°
γ	90°
Cell volume	2247.81 ± 0.17 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0427
Residual factor for significantly intense reflections	0.033
Weighted residual factors for significantly intense reflections	0.0826
Weighted residual factors for all reflections included in the refinement	0.0879
Goodness-of-fit parameter for all reflections included in the refinement	1.03
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
225978 (current)	2019-11-10	cif/ Adding structures of 4515899 via cif-deposit CGI script.	4515899.cif