Crystallography Open Database

Information card for entry 4510985

Preview

Coordinates	4510985.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	bis-(2-hydroxy-pyridine-n-oxide) zinc
Formula	C10 H8 N2 O4 Zn
Calculated formula	C10 H8 N2 O4 Zn
Title of publication	Modifying Lipophilicities of Zn(II) Coordination Species by Introduction of Ancillary Ligands: A Supramolecular Chemistry Approach
Authors of publication	Ma, Zhenbo; Hopson, Russell; Cai, Chen; Han, Shuangbing; Moulton, Brian
Journal of publication	Crystal Growth & Design
Year of publication	2010
Journal volume	10
Journal issue	5
Pages of publication	2376
a	6.343 ± 0.009 Å
b	8.856 ± 0.013 Å
c	9.599 ± 0.014 Å
α	81.49 ± 0.02°
β	79.87 ± 0.02°
γ	81.3 ± 0.02°
Cell volume	520.6 ± 1.3 Å³
Cell temperature	90 ± 2 K
Ambient diffraction temperature	90 ± 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	0.0795
Residual factor for significantly intense reflections	0.0698
Weighted residual factors for significantly intense reflections	0.1883
Weighted residual factors for all reflections included in the refinement	0.2008
Goodness-of-fit parameter for all reflections included in the refinement	1.078
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
179656 (current)	2016-03-24	cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/09.	4510985.cif
114463	2014-05-24	cif/ Adding structures of 4510985 via cif-deposit CGI script.	4510985.cif