Crystallography Open Database

Information card for entry 4324998

Preview

Coordinates	4324998.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H46 F7 N4 O6 Pt S2
Calculated formula	C36 H46 F6 N4 O7 Pt S2
Title of publication	Pt(II) and Pt(IV) Amido, Aryloxide, and Hydrocarbyl Complexes: Synthesis, Characterization, and Reaction with Dihydrogen and Substrates that Possess C-H Bonds
Authors of publication	Joanna R. Webb; Colleen Munro-Leighton; Aaron W. Pierpont; Joshua T. Gurkin; T. Brent Gunnoe; Thomas R. Cundari; Michal Sabat; Jeffrey L. Petersen; Paul D. Boyle
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	4195 - 4211
a	12.6369 ± 0.0008 Å
b	13.5447 ± 0.0004 Å
c	14.7681 ± 0.0004 Å
α	114.171 ± 0.001°
β	100.285 ± 0.001°
γ	96.691 ± 0.001°
Cell volume	2217.88 ± 0.17 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0764
Residual factor for significantly intense reflections	0.0548
Weighted residual factors for significantly intense reflections	0.1577
Weighted residual factors for all reflections included in the refinement	0.1727
Goodness-of-fit parameter for all reflections included in the refinement	1.158
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
179352 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/49.	4324998.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4324998.cif
43449	2012-03-14	../uploads/cif-deposit/cod/cif Adding structures of 4324998 via cif-deposit CGI script.	4324998.cif