Crystallography Open Database

Information card for entry 7052165

Preview

Coordinates	7052165.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37.78 H41.78 Cl2.34 N3 O2 Zn
Calculated formula	C37.7805 H41 Cl2.3415 N3 O2 Zn
Title of publication	Zinc‒salophen complexes as selective receptors for tertiary amines
Authors of publication	Dalla Cort, Antonella; Mandolini, Luigi; Pasquini, Chiara; Rissanen, Kari; Russo, Luca; Schiaffino, Luca
Journal of publication	New Journal of Chemistry
Year of publication	2007
Journal volume	31
Journal issue	9
Pages of publication	1633
a	21.55 ± 0.004 Å
b	11.749 ± 0.002 Å
c	30.5348 ± 0.0006 Å
α	90°
β	109.83 ± 0.03°
γ	90°
Cell volume	7273 ± 2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.2408
Residual factor for significantly intense reflections	0.1953
Weighted residual factors for significantly intense reflections	0.4063
Weighted residual factors for all reflections included in the refinement	0.4311
Goodness-of-fit parameter for all reflections included in the refinement	1.124
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180075 (current)	2016-03-26	cif/7/05/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/05/21.	7052165.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7052165.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7052165.cif
1188	2010-06-06	cif/{1,7}/ Adding CIFs from Miguel-Quiros-2010_05, New-J-Chem-2007, Org-Biomol-Chem-2007 and RSC-2007 data extraction directories.	7052165.cif