Crystallography Open Database

Information card for entry 1512950

Preview

Coordinates	1512950.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H16 Ag F3 N6 O3
Calculated formula	C20 H16 Ag F3 N6 O3
Title of publication	Solvent-regulated assemblies of silver(I) and cadmium(II) supramolecular complexes with versatile tripyridyltriazole multidentate ligands
Authors of publication	Jian Guo; Cheng-Peng Li; Miao Du
Journal of publication	Inorganica Chimica Acta
Year of publication	2013
Journal volume	395
Pages of publication	212 - 217
a	10.2782 ± 0.0008 Å
b	6.7755 ± 0.0005 Å
c	29.893 ± 0.002 Å
α	90°
β	91.903 ± 0.002°
γ	90°
Cell volume	2080.6 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0753
Residual factor for significantly intense reflections	0.0555
Weighted residual factors for significantly intense reflections	0.1435
Weighted residual factors for all reflections included in the refinement	0.1572
Goodness-of-fit parameter for all reflections included in the refinement	1.03
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
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1512950.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1512950.cif
91282	2013-12-11	cif/ Adding structures of 1512950 via cif-deposit CGI script.	1512950.cif