Crystallography Open Database

Information card for entry 7110585

Preview

Coordinates	7110585.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	[PtCl(PMe3)(C15H32O3P3)].2.5(CH2Cl2)
Formula	C20.5 H46 Cl6 O3 P4 Pt
Calculated formula	C20.5 H47 Cl6 O3 P4 Pt
Title of publication	First η1-ligated 2,4,6-tri-tert-butyl-1,3,5-triphosphabenzene complexes and the remarkable trihydration reaction of trans-[PtCl2(PMe3)(P3C3But3)] to cis-[PtCl(PMe3)(P3O3C3H5But3)], containing the novel CH(But)PH(O)C(But)PH(O)CH(But)P(O) ring system
Authors of publication	Clendenning, Scott B.; Hitchcock, Peter B.; Nixon, John F.
Journal of publication	Chemical Communications
Year of publication	1999
Journal issue	15
Pages of publication	1377
a	14.508 ± 0.009 Å
b	15.924 ± 0.009 Å
c	29.018 ± 0.012 Å
α	90°
β	90°
γ	90°
Cell volume	6704 ± 6 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	64
Hermann-Mauguin space group symbol	C m c a
Hall space group symbol	-C 2ac 2
Residual factor for all reflections	0.0921
Residual factor for significantly intense reflections	0.0746
Weighted residual factors for significantly intense reflections	0.1957
Weighted residual factors for all reflections included in the refinement	0.2088
Goodness-of-fit parameter for all reflections included in the refinement	1.12
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7110585.cif
95451	2014-01-28	cif/ Adding structures of 7110585 via cif-deposit CGI script.	7110585.cif