Crystallography Open Database

Information card for entry 7035966

Preview

Coordinates	7035966.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	trans-[PtCl2{PPh2(CF=CF(CF3))}2]
Formula	C30 H20 Cl2 F10 P2 Pt
Calculated formula	C30 H20 Cl2 F10 P2 Pt
SMILES	C(=C(\C(F)(F)F)F)(F)\[P](c1ccccc1)(c1ccccc1)[Pt](Cl)(Cl)[P](C(=C(C(F)(F)F)\F)\F)(c1ccccc1)c1ccccc1
Title of publication	Perfluoropropenyl-containing phosphines from HFC replacements.
Authors of publication	Brisdon, Alan K.; Ali Ghaba, Hana; Beutel, Bernd; Egjandi, Amina; Addaraidi, Arij; Pritchard, Robin G.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	45
Pages of publication	19717 - 19731
a	10.5209 ± 0.0002 Å
b	11.603 ± 0.0003 Å
c	14.037 ± 0.0004 Å
α	106.03 ± 0.001°
β	90.45 ± 0.001°
γ	109.124 ± 0.001°
Cell volume	1546.89 ± 0.07 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0766
Residual factor for significantly intense reflections	0.0535
Weighted residual factors for significantly intense reflections	0.1187
Weighted residual factors for all reflections included in the refinement	0.1372
Goodness-of-fit parameter for all reflections included in the refinement	1.048
Diffraction radiation probe	x-ray
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
171173 (current)	2015-12-09	cif/ Updating files of 7035966, 7035967, 7035968, 7035969, 7035970, 7035971, 7035972, 7035973 Original log message: Adding full bibliography for 7035966--7035973.cif.	7035966.cif
152575	2015-07-28	cif/ Adding structures of 7035966, 7035967, 7035968, 7035969, 7035970, 7035971, 7035972, 7035973 via cif-deposit CGI script.	7035966.cif