Crystallography Open Database

Information card for entry 7116108

Preview

Coordinates	7116108.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H53 Ag B Cl8 F Fe2 O6 P4
Calculated formula	C48 H53 Ag B Cl8 F Fe2 O6 P4
Title of publication	Silver(I) and thallium(I) cations as unsupported bridges between two metal bases
Authors of publication	Holger Braunschweig; Rian D. Dewhurst; Florian Hupp; Christoph Schneider
Journal of publication	Chem.Commun.
Year of publication	2014
Journal volume	50
Pages of publication	15685
a	18.93 ± 0.005 Å
b	23.904 ± 0.003 Å
c	26.047 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	11786 ± 4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	9
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0587
Residual factor for significantly intense reflections	0.033
Weighted residual factors for significantly intense reflections	0.0603
Weighted residual factors for all reflections included in the refinement	0.0677
Goodness-of-fit parameter for all reflections included in the refinement	1.018
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
180275 (current)	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/61.	7116108.cif
129048	2014-12-24	cif/ Adding structures of 7116106, 7116107, 7116108 via cif-deposit CGI script.	7116108.cif