Crystallography Open Database

Information card for entry 7109447

Preview

Coordinates	7109447.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C55 H47 Cl8 Cu F9 N4 O9 P2 S5
Calculated formula	C55 H47 Cl8 Cu F9 N4 O9 P2 S5
Title of publication	Syntheses of CuI polymetallic assemblies from reaction of ligands bearing the 2,5-bis(2-pyridyl)phosphole fragment with CuII precursors
Authors of publication	Mehdi El Sayed Moussa; Fabian Friess; Wenting Shen; Muriel Hissler; Regis Reau; Christophe Lescop
Journal of publication	Chem.Commun.
Year of publication	2013
Journal volume	49
Pages of publication	6158
a	15.993 ± 0.002 Å
b	26.367 ± 0.003 Å
c	32.189 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	13574 ± 3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	9
Space group number	56
Hermann-Mauguin space group symbol	P n a a
Hall space group symbol	-P 2ac 2bc
Residual factor for all reflections	0.177
Residual factor for significantly intense reflections	0.1098
Weighted residual factors for significantly intense reflections	0.2273
Weighted residual factors for all reflections included in the refinement	0.2576
Goodness-of-fit parameter for all reflections included in the refinement	1.111
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180198 (current)	2016-03-26	cif/7/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/10/94.	7109447.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7109447.cif
86340	2013-06-21	cif/ Adding structures of 7109442, 7109443, 7109444, 7109445, 7109446, 7109447 via cif-deposit CGI script.	7109447.cif