Crystallography Open Database

Information card for entry 4108380

Preview

Coordinates	4108380.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H20 B F10 P
Calculated formula	C20 H19 B F10 P
Title of publication	Activation of H2 by Phosphinoboranes R2PB(C6F5)2
Authors of publication	Stephen J. Geier; Thomas M. Gilbert; Douglas W. Stephan
Journal of publication	Journal of the American Chemical Society
Year of publication	2008
Journal volume	130
Pages of publication	12632 - 12633
a	9.542 ± 0.0017 Å
b	12.872 ± 0.002 Å
c	19.447 ± 0.003 Å
α	96.656 ± 0.002°
β	95.583 ± 0.002°
γ	109.144 ± 0.002°
Cell volume	2217.8 ± 0.6 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	0.2563
Residual factor for significantly intense reflections	0.0949
Weighted residual factors for significantly intense reflections	0.2123
Weighted residual factors for all reflections included in the refinement	0.2839
Goodness-of-fit parameter for all reflections included in the refinement	0.952
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
178829 (current)	2016-03-21	cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/83.	4108380.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4108380.cif
56734	2012-05-15	cif/ Adding structures of 4108380 via cif-deposit CGI script.	4108380.cif