Crystallography Open Database

Information card for entry 8105670

Preview

Coordinates	8105670.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H44 Cl2 N4 O12 Zn3
Calculated formula	C36 H44 Cl2 N4 O12 Zn3
Title of publication	Crystal structure of diaqua-dichlorido-bis(μ3-6,6′-(hydrazine-1,2-diylidenebis(methanylylidene))bis(2-methoxyphenolato)κ6 O,N:N′,O′,O′:O′′)trizinc(II) - ethanol (1/2), C36H44Cl2N4O12Zn3
Authors of publication	Tan, Yuye; Huang, Junjie; Lu, Hui; Sun, Jianhua
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2019
Journal volume	234
Journal issue	3
Pages of publication	431 - 432
a	8.3378 ± 0.0008 Å
b	21.188 ± 0.002 Å
c	22.802 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	4028.2 ± 0.6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0755
Residual factor for significantly intense reflections	0.0513
Weighted residual factors for significantly intense reflections	0.1051
Weighted residual factors for all reflections included in the refinement	0.1193
Goodness-of-fit parameter for all reflections included in the refinement	1.071
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
276746 (current)	2022-07-11	cif/ Adding structures of 8105670 via cif-deposit CGI script.	8105670.cif