Crystallography Open Database

Information card for entry 7718167

Preview

Coordinates	7718167.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C63 H58 N16 O8 Zn2
Calculated formula	C63 H58 N16 O8 Zn2
Title of publication	A mononuclear zinc(II) complex and a tetranuclear copper(II) azametallacoronate with (E)−2−((2−(quinazolin−4−yl)hydrazono)methyl)phenol: Structure and biological activity
Authors of publication	Kakoulidou, Chrisoula; Hatzidimitriou, Antonios; Fylaktakidou, Konstantina C.; Psomas, George L.
Journal of publication	Dalton Transactions
Year of publication	2025
a	20.8047 ± 0.001 Å
b	11.9286 ± 0.0008 Å
c	26.7212 ± 0.0012 Å
α	90°
β	111.086 ± 0.007°
γ	90°
Cell volume	6187.4 ± 0.7 Å³
Cell temperature	295 K
Ambient diffraction temperature	295 K
Number of distinct elements	5
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	0.0868
Residual factor for significantly intense reflections	0.0497
Weighted residual factors for all reflections	0.0925
Weighted residual factors for significantly intense reflections	0.0679
Weighted residual factors for all reflections included in the refinement	0.0679
Goodness-of-fit parameter for all reflections included in the refinement	1
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
297911 (current)	2025-02-28	cif/ Adding structures of 7718165, 7718166, 7718167 via cif-deposit CGI script.	7718167.cif