Information card for entry 7028355

Structure parameters

• Formula: C16 H14 N2 Pt Se2
• Calculated formula: C16 H14 N2 Pt Se2
• SMILES: [Pt]123[N](CC[N]3=Cc3c([Se]1)cccc3)=Cc1c([Se]2)cccc1
• Title of publication: Oxidative addition of disulfide/diselenide to group 10 metal(0) and in situ functionalization to form neutral thiasalen/selenasalen group 10 metal(II) complexes.
• Authors of publication: Dutta, Pradip Kr; Asatkar, Ashish K.; Zade, Sanjio S.; Panda, Snigdha
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 4
• Pages of publication: 1736 - 1743
• a: 10.494 ± 0.0012 Å
• b: 12.1603 ± 0.0015 Å
• c: 12.8887 ± 0.0016 Å
• α: 72.482 ± 0.002°
• β: 85.863 ± 0.002°
• γ: 83.337 ± 0.002°
• Cell volume: 1556.7 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0408
• Residual factor for significantly intense reflections: 0.0319
• Weighted residual factors for significantly intense reflections: 0.0817
• Weighted residual factors for all reflections included in the refinement: 0.0856
• Goodness-of-fit parameter for all reflections included in the refinement: 1.149
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No