Crystallography Open Database

Information card for entry 7004077

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Coordinates	7004077.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H24 F10 P2 Pd
Calculated formula	C38 H24 F10 P2 Pd
SMILES	[Pd]1([P](c2ccccc2)(c2ccccc2)CC[P]1(c1ccccc1)c1ccccc1)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F
Title of publication	Reductive elimination of C6F5‒C6F5 in the reaction of bis(pentafluorophenyl)palladium(ii) complexes with protic acids
Authors of publication	Koizumi, Take-aki; Yamazaki, Atsuko; Yamamoto, Takakazu
Journal of publication	Dalton Transactions
Year of publication	2008
Journal issue	30
Pages of publication	3949 - 3952
a	13.596 ± 0.003 Å
b	16.662 ± 0.004 Å
c	15.608 ± 0.003 Å
α	90°
β	98.7817 ± 0.0011°
γ	90°
Cell volume	3494.3 ± 1.3 Å³
Cell temperature	293.1 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for significantly intense reflections	0.0319
Weighted residual factors for all reflections included in the refinement	0.042
Goodness-of-fit parameter for all reflections included in the refinement	0.947
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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