Crystallography Open Database

Information card for entry 4072722

Preview

Coordinates	4072722.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Compound 1
Formula	C47 H37 B F24 P Rh
Calculated formula	C47 H37 B F24 P Rh
Title of publication	Rhodium Phosphine Olefin Complexes of the Weakly Coordinating Anions [BArF4]-and [1-closo-CB11H6Br6]-. Kinetic versus Thermodynamic Factors in Anion Coordination and Complex Reactivity
Authors of publication	Douglas, Thomas M.; Molinos, Eduardo; Brayshaw, Simon K.; Weller, Andrew S.
Journal of publication	Organometallics
Year of publication	2007
Journal volume	26
Journal issue	3
Pages of publication	463
a	12.1862 ± 0.0001 Å
b	22.2631 ± 0.0002 Å
c	18.4958 ± 0.0001 Å
α	90°
β	108.775 ± 0.0004°
γ	90°
Cell volume	4750.94 ± 0.06 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
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	0.0538
Residual factor for significantly intense reflections	0.0445
Weighted residual factors for significantly intense reflections	0.1114
Weighted residual factors for all reflections included in the refinement	0.1165
Goodness-of-fit parameter for all reflections included in the refinement	1.091
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
178616 (current)	2016-03-21	cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/27.	4072722.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4072722.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4072722.cif
45969	2012-03-21	../uploads/cif-deposit/cod/cif Adding structures of 4072722, 4072723 via cif-deposit CGI script.	4072722.cif