Crystallography Open Database

Information card for entry 7025778

Preview

Coordinates	7025778.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H18 Br2 O6 P2 Pt
Calculated formula	C6 H18 Br2 O6 P2 Pt
SMILES	[Pt](Br)(Br)([P](OC)(OC)OC)[P](OC)(OC)OC
Title of publication	Correlating Pt-P bond lengths and Pt-P coupling constants.
Authors of publication	Waddell, Paul G.; Slawin, Alexandra M. Z.; Woollins, J. Derek
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	37
Pages of publication	8620 - 8625
a	12.6116 ± 0.0009 Å
b	7.6773 ± 0.0006 Å
c	16.0931 ± 0.0012 Å
α	90°
β	90°
γ	90°
Cell volume	1558.2 ± 0.2 Å³
Cell temperature	125.1 K
Ambient diffraction temperature	125.1 K
Number of distinct elements	6
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for significantly intense reflections	0.0335
Weighted residual factors for all reflections included in the refinement	0.0664
Goodness-of-fit parameter for all reflections included in the refinement	1.054
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7025778.html