Crystallography Open Database

Information card for entry 7116107

Preview

Coordinates	7116107.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C96 H144 B Cl8 P4 Pt2 Tl
Calculated formula	C96 H144 B Cl8 P4 Pt2 Tl
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	20.429 ± 0.007 Å
b	17.201 ± 0.006 Å
c	27.925 ± 0.01 Å
α	90°
β	99.446 ± 0.009°
γ	90°
Cell volume	9680 ± 6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
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	0.0383
Residual factor for significantly intense reflections	0.0282
Weighted residual factors for significantly intense reflections	0.0605
Weighted residual factors for all reflections included in the refinement	0.0637
Goodness-of-fit parameter for all reflections included in the refinement	1.009
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.	7116107.cif
129048	2014-12-24	cif/ Adding structures of 7116106, 7116107, 7116108 via cif-deposit CGI script.	7116107.cif