Information card for entry 2016406

Structure parameters

• Chemical name: bis(N-benzoyl-N',N'-dibutylselenoureato-κ^2^Se,O)palladium(II)
• Formula: C32 H46 N4 O2 Pd Se2
• Calculated formula: C32 H46 N4 O2 Pd Se2
• SMILES: [Pd]12([O]=C(N=C([Se]1)N(CCCC)CCCC)c1ccccc1)[Se]C(N(CCCC)CCCC)=NC(=[O]2)c1ccccc1
• Title of publication: <i>N</i>-Benzoyl-<i>N</i>',<i>N</i>'-dibutylselenourea and its palladium(II) complex
• Authors of publication: Jocelyn C. Bruce; Klaus R. Koch
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 1
• Pages of publication: m1 - m4
• a: 9.9302 ± 0.0008 Å
• b: 10.9315 ± 0.0009 Å
• c: 15.4119 ± 0.0013 Å
• α: 80.216 ± 0.001°
• β: 88.291 ± 0.001°
• γ: 81.867 ± 0.001°
• Cell volume: 1632 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0244
• Residual factor for significantly intense reflections: 0.0221
• Weighted residual factors for significantly intense reflections: 0.0554
• Weighted residual factors for all reflections included in the refinement: 0.0563
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes