Information card for entry 4318017

Structure parameters

• Common name: Dimethylaminoethyltellurolato-chloro-(tris(n-propyl)phophine)palladium(II)
• Formula: C13 H31 Cl N P Pd Te
• Calculated formula: C13 H31 Cl N P Pd Te
• SMILES: [Pd]1([Te]CC[N]1(C)C)(Cl)[P](CCC)(CCC)CCC
• 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: 8.413 ± 0.002 Å
• b: 10.709 ± 0.003 Å
• c: 11.406 ± 0.003 Å
• α: 74.096 ± 0.017°
• β: 85.768 ± 0.018°
• γ: 72.795 ± 0.019°
• Cell volume: 944 ± 0.4 ų
• 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: 0.043
• Residual factor for significantly intense reflections: 0.0332
• Weighted residual factors for significantly intense reflections: 0.0799
• Weighted residual factors for all reflections included in the refinement: 0.085
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No