Crystallography Open Database

Information card for entry 4074725

Preview

Coordinates	4074725.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C68 H58 O2 P2 Pt2 S2
Calculated formula	C136 H116 O4 P4 Pt4 S4
Title of publication	Reactions of α,β-Unsaturated Thioesters with Platinum(0): Implication of a Dual Mechanism Leading to the Formation of Acyl Platinum†
Authors of publication	Minami, Yasunori; Kato, Tomohiro; Kuniyasu, Hitoshi; Terao, Jun; Kambe, Nobuaki
Journal of publication	Organometallics
Year of publication	2006
Journal volume	25
Journal issue	12
Pages of publication	2949
a	10.95 ± 0.001 Å
b	11.2767 ± 0.0008 Å
c	12.122 ± 0.001 Å
α	101.256 ± 0.003°
β	92.958 ± 0.004°
γ	103.578 ± 0.006°
Cell volume	1419.5 ± 0.2 Å³
Cell temperature	223.2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for significantly intense reflections	0.0395
Weighted residual factors for all reflections included in the refinement	0.1056
Goodness-of-fit parameter for all reflections included in the refinement	1.758
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4074725.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4074725.cif
48708	2012-03-27	../uploads/cif-deposit/cod/cif Adding structures of 4074725 via cif-deposit CGI script.	4074725.cif