Crystallography Open Database

Information card for entry 2243268

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Structure parameters

Chemical name	Bis{3,4,5-trimethoxy-<i>N</i>'-[1-(pyridin-2-yl)ethylidene]benzohydrazidato}zinc(II)
Formula	C37 H46 N6 O10 Zn
Calculated formula	C37 H36 N6 O10 Zn
SMILES	[Zn]1234([n]5ccccc5C(=[N]1N=C(O3)c1cc(OC)c(OC)c(OC)c1)C)[n]1ccccc1C(=[N]2N=C(O4)c1cc(OC)c(OC)c(OC)c1)C.CO.C(O)C
Title of publication	Crystal structure of the mixed methanol and ethanol solvate of bis{3,4,5-trimethoxy-<i>N</i>'-[1-(pyridin-2-yl)ethylidene]benzohydrazidato}zinc(II)
Authors of publication	Znovjyak, Kateryna; Fritsky, Igor O.; Sliva, Tatiana Y.; Amirkhanov, Vladimir M.; Seredyuk, Maksym
Journal of publication	Acta Crystallographica Section E
Year of publication	2020
Journal volume	76
Journal issue	3
Pages of publication	303 - 308
a	11.0402 ± 0.0004 Å
b	13.8056 ± 0.0008 Å
c	14.419 ± 0.0007 Å
α	63.256 ± 0.005°
β	74.098 ± 0.004°
γ	75.307 ± 0.004°
Cell volume	1865.63 ± 0.18 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 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	0.0812
Residual factor for significantly intense reflections	0.064
Weighted residual factors for significantly intense reflections	0.1712
Weighted residual factors for all reflections included in the refinement	0.1922
Goodness-of-fit parameter for all reflections included in the refinement	0.895
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
247942 (current)	2020-02-07	cif/ hkl/ Adding structures of 2243268 via cif-deposit CGI script.	2243268.cif 2243268.hkl