Crystallography Open Database

Information card for entry 7714826

Preview

Coordinates	7714826.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C72 H86 Br8 Cl4 N32 O29 Zn4
Calculated formula	C68 H60 Br8 Cl4 N32 O20 Zn4
Title of publication	Novel tetranuclear grid-like Zn(II) complexes derived from dihydrazone pyrimidine derivatives as antitumor agents.
Authors of publication	Yuan, Juan; Lan, Hai-Rong; Xing, Ai-Ping; Zeng, Dai; Hao, Ya-Ting; Song, Jun-Ying; Lu, Jia-Xing; Zhang, Bin; Wang, Jing; Zhang, Zhen-Qiang
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	5
Pages of publication	2193 - 2206
a	22.5744 ± 0.0009 Å
b	22.5744 ± 0.0009 Å
c	12.3918 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	6314.9 ± 0.5 Å³
Cell temperature	173 K
Ambient diffraction temperature	173 K
Number of distinct elements	7
Space group number	137
Hermann-Mauguin space group symbol	P 42/n m c :2
Hall space group symbol	-P 4ac 2a
Residual factor for all reflections	0.0757
Residual factor for significantly intense reflections	0.0612
Weighted residual factors for significantly intense reflections	0.2026
Weighted residual factors for all reflections included in the refinement	0.2192
Goodness-of-fit parameter for all reflections included in the refinement	1.103
Diffraction radiation wavelength	1.34139 Å
Diffraction radiation type	GaKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
289481 (current)	2024-02-04	cif/ Updating files of 7714826, 7714827, 7714828 Original log message: Adding full bibliography for 7714826--7714828.cif.	7714826.cif
288516	2023-12-23	cif/ Adding structures of 7714826, 7714827, 7714828 via cif-deposit CGI script.	7714826.cif