Crystallography Open Database

Information card for entry 8104729

Preview

Coordinates	8104729.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H30 N4 O8 Zn
Calculated formula	C32 H30 N4 O8 Zn
Title of publication	The crystal structure of catena-poly[diaqua-bis(μ2-2-((2-(2-phenylacetyl)hydrazineylidene)methyl)benzoato-κ2 O:O')zinc(II)], C32H30N4O8Zn
Authors of publication	Du, Lian-Cai; Tai, Xi-Shi
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2021
Journal volume	236
Journal issue	4
Pages of publication	843 - 844
a	4.408 ± 0.0003 Å
b	12.1316 ± 0.001 Å
c	14.0769 ± 0.0012 Å
α	102.81 ± 0.007°
β	97.455 ± 0.007°
γ	97.982 ± 0.007°
Cell volume	716.81 ± 0.1 Å³
Cell temperature	149.99 ± 0.1 K
Ambient diffraction temperature	149.99 ± 0.1 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0431
Residual factor for significantly intense reflections	0.0367
Weighted residual factors for significantly intense reflections	0.0731
Weighted residual factors for all reflections included in the refinement	0.0761
Goodness-of-fit parameter for all reflections included in the refinement	1.047
Diffraction radiation probe	x-ray
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
273606 (current)	2022-03-10	cif/ Adding structures of 8104729 via cif-deposit CGI script.	8104729.cif