Crystallography Open Database

Information card for entry 1100892

Preview

Coordinates	1100892.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H8 F20 O0.18 P2
Calculated formula	C32 H8 F20 O0.18 P2
Title of publication	Electron-Poor Pentafluorophenyl-Substituted PCP‒Palladium Pincer Complexes
Authors of publication	Chase, Preston A.; Gagliardo, Marcella; Lutz, Martin; Spek, Anthony L.; van Klink, Gerard P. M.; van Koten, Gerard
Journal of publication	Organometallics
Year of publication	2005
Journal volume	24
Journal issue	9
Pages of publication	2016 - 2019
a	6.0387 ± 0.0001 Å
b	32.3369 ± 0.0005 Å
c	15.9373 ± 0.0002 Å
α	90°
β	103.062 ± 0.0006°
γ	90°
Cell volume	3031.6 ± 0.08 Å³
Cell temperature	125 ± 2 K
Ambient diffraction temperature	125 ± 2 K
Number of distinct elements	5
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	0.0615
Residual factor for significantly intense reflections	0.0381
Weighted residual factors for significantly intense reflections	0.0929
Weighted residual factors for all reflections included in the refinement	0.1046
Goodness-of-fit parameter for all reflections included in the refinement	1.072
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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