Crystallography Open Database

Information card for entry 7714828

Preview

Coordinates	7714828.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C95 H122 Cl8 N32 O50 Zn4
Calculated formula	C93 H72 Cl7 N32 O44 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	24.7935 ± 0.0004 Å
b	24.8747 ± 0.0004 Å
c	21.634 ± 0.0004 Å
α	90°
β	102.101 ± 0.002°
γ	90°
Cell volume	13045.9 ± 0.4 Å³
Cell temperature	100.15 K
Ambient diffraction temperature	100.15 K
Number of distinct elements	6
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.1061
Residual factor for significantly intense reflections	0.1011
Weighted residual factors for significantly intense reflections	0.2956
Weighted residual factors for all reflections included in the refinement	0.3019
Goodness-of-fit parameter for all reflections included in the refinement	1.086
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
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.	7714828.cif
288516	2023-12-23	cif/ Adding structures of 7714826, 7714827, 7714828 via cif-deposit CGI script.	7714828.cif