Crystallography Open Database

Information card for entry 4121364

Preview

Coordinates	4121364.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37 H61.5 B Cl6 F4 N4 P Pt
Calculated formula	C37 H61.5 B Cl6 F4 N4 P Pt
Title of publication	Polycationic Ligands in Gold Catalysis: Synthesis and Applications of Extremely π-Acidic Catalysts
Authors of publication	Javier Carreras; Gopinadhanpillai Gopakumar; Liangu Gu; Ana Gimeno; Pawel Linowski; Jekaterina Petuškova; Walter Thiel; Manuel Alcarazo
Journal of publication	Journal of the American Chemical Society
Year of publication	2013
Journal volume	135
Pages of publication	18815 - 18823
a	25.819 ± 0.003 Å
b	15.859 ± 0.002 Å
c	25.45 ± 0.002 Å
α	90°
β	113.707 ± 0.006°
γ	90°
Cell volume	9541.5 ± 1.9 Å³
Cell temperature	200 K
Ambient diffraction temperature	200 K
Number of distinct elements	8
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	0.0969
Residual factor for significantly intense reflections	0.0822
Weighted residual factors for significantly intense reflections	0.2045
Weighted residual factors for all reflections included in the refinement	0.2135
Goodness-of-fit parameter for all reflections included in the refinement	1.208
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4121364.cif
107568	2014-03-20	cif/ Adding structures of 4121364 via cif-deposit CGI script.	4121364.cif