Crystallography Open Database

Information card for entry 8102310

Preview

Coordinates	8102310.cif

Structure parameters

Formula	C208 H168 N48 O36 Zn8
Calculated formula	C208 H168 N48 O36 Zn8
Title of publication	Crystal structure of bis(pyridine-2-carboxaldehyde-2-hydroxybenzoyl hydrazone)zinc(II) semihydrate, Zn(C13H10N3O2)2 · 0.5 H2O
Authors of publication	Xinsheng Wan; Caoyuan Niu; Xianfu Zheng; Chunhong Kou
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2008
Journal volume	223
Journal issue	3
Pages of publication	279
a	18.19 ± 0.012 Å
b	24.61 ± 0.016 Å
c	11.519 ± 0.011 Å
α	90°
β	103.595 ± 0.018°
γ	90°
Cell volume	5012 ± 7 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1141
Residual factor for significantly intense reflections	0.0595
Weighted residual factors for significantly intense reflections	0.1634
Weighted residual factors for all reflections included in the refinement	0.1973
Goodness-of-fit parameter for all reflections included in the refinement	1.058
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
211175 (current)	2018-09-26	cif/ Removing _chemical_name_systematic and _chemical_name_common data items with placeholder values from 513 entries in range 8.	8102310.cif
176432	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	8102310.cif
35911	2012-02-28	cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree.	8102310.cif
13049	2011-03-06	../uploads/cif-deposit/cod/cif Adding structures of 8102310 via cif-deposit CGI script.	8102310.cif