Information card for entry 4318020

Structure parameters

• Common name: Dimethylaminoethylselenolato-chloro-(triethylphophine)platinum(II)
• Formula: C10 H25 Cl N P Pt Se
• Calculated formula: C10 H25 Cl N P Pt Se
• SMILES: [Pd]1([Se]CC[N]1(C)C)(Cl)[P](CC)(CC)CC
• Title of publication: Structural Basis for Unusually Long Wavelength Charge Transfer Transitions in Complexes [MCl(ECH2CH2NMe2)(PR3)] (E = Te, Se; M = Pt, Pd): Experimental Results and TD-DFT Calculations
• Authors of publication: Sandip Dey; Vimal K. Jain; Axel Knödler; Axel Klein; Wolfgang Kaim; Stanislav Záliš
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 2864 - 2870
• a: 9.6374 ± 0.0019 Å
• b: 11.5216 ± 0.0016 Å
• c: 13.917 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1545.3 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0557
• Residual factor for significantly intense reflections: 0.0424
• Weighted residual factors for significantly intense reflections: 0.0986
• Weighted residual factors for all reflections included in the refinement: 0.1064
• Goodness-of-fit parameter for all reflections included in the refinement: 0.971
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No