Crystallography Open Database

Information card for entry 4516935

Preview

Coordinates	4516935.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H44 Cl2 Cu2 P2 Pt S2
Calculated formula	C30 H44 Cl2 Cu2 P2 Pt S2
Title of publication	The <i>trans</i>-Bis(<i>p</i>-thioetherphenylacetynyl)bis(phosphine)platinum(II) Ligands: A Step towards Predictability and Crystal Design.
Authors of publication	Juvenal, Frank; Bonnot, Antoine; Fortin, Daniel; Harvey, Pierre D.
Journal of publication	ACS omega
Year of publication	2017
Journal volume	2
Journal issue	10
Pages of publication	7433 - 7443
a	9.11 ± 0.002 Å
b	9.191 ± 0.002 Å
c	12.721 ± 0.003 Å
α	69.754 ± 0.005°
β	85.301 ± 0.005°
γ	63.395 ± 0.004°
Cell volume	890.1 ± 0.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 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	0.0351
Residual factor for significantly intense reflections	0.0303
Weighted residual factors for significantly intense reflections	0.0754
Weighted residual factors for all reflections included in the refinement	0.0773
Goodness-of-fit parameter for all reflections included in the refinement	1.077
Diffraction radiation probe	x-ray
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
239641 (current)	2019-11-24	cif/ Adding structures of 4516935 via cif-deposit CGI script.	4516935.cif