Crystallography Open Database

Information card for entry 4324163

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Coordinates	4324163.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H12 B F10 P
Calculated formula	C16 H12 B F10 P
SMILES	[BH]([PH](CC)CC)(c1c(c(c(c(c1F)F)F)F)F)c1c(c(c(c(c1F)F)F)F)F
Title of publication	Synthesis and Reactivity of the Phosphinoboranes R2PB(C6F5)2
Authors of publication	Stephen J. Geier; Thomas M. Gilbert; Douglas W. Stephan
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	336 - 344
a	9.198 ± 0.006 Å
b	12.989 ± 0.008 Å
c	15.681 ± 0.009 Å
α	83.854 ± 0.006°
β	87.955 ± 0.007°
γ	75.462 ± 0.006°
Cell volume	1803 ± 1.9 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0583
Residual factor for significantly intense reflections	0.0493
Weighted residual factors for significantly intense reflections	0.136
Weighted residual factors for all reflections included in the refinement	0.1457
Goodness-of-fit parameter for all reflections included in the refinement	1.046
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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