Information card for entry 2103293

Structure parameters

• Common name: trans-di(thiocyanate)bis(tribenzylphosphine)platinum(II)
• Formula: C47 H45 N2 P2 Pt S2
• Calculated formula: C47 H45 N2 P2 Pt S2
• SMILES: N(=C=S)[Pt]([P](Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1)(N=C=S)[P](Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1.c1ccccc1
• Title of publication: Structures of <i>trans</i>-[PtCl~2~(PBz~3~)~2~], <i>trans</i>-[PtI~2~(PBz~3~)~2~], <i>trans</i>-[Pt(NCS)~2~(PBz~3~)~2~]·0.5C~6~H~6~ and <i>trans</i>-[PdI~2~(PBz~3~)~2~]
• Authors of publication: Johansson, Maria H.; Otto, Stefanus; Oskarsson, Åke
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 2
• Pages of publication: 244 - 250
• a: 9.5006 ± 0.0019 Å
• b: 11.8 ± 0.002 Å
• c: 19.112 ± 0.004 Å
• α: 83.99 ± 0.03°
• β: 89.87 ± 0.03°
• γ: 81.98 ± 0.03°
• Cell volume: 2109.8 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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 all reflections: 0.1001
• Residual factor for significantly intense reflections: 0.0425
• Weighted residual factors for significantly intense reflections: 0.0753
• Weighted residual factors for all reflections included in the refinement: 0.0868
• Goodness-of-fit parameter for all reflections included in the refinement: 0.868
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes