Information card for entry 2222297

Structure parameters

• Chemical name: [(2,3,5,6-η)-Bicyclo[2.2.1]hepta-2,5-diene]dibromidopalladium(II)
• Formula: C7 H8 Br2 Pd
• Calculated formula: C7 H8 Br2 Pd
• SMILES: [CH]12C3CC4[CH]=2[Pd]21([CH]3=[CH]42)(Br)Br
• Title of publication: [(2,3,5,6-η)-Bicyclo[2.2.1]hepta-2,5-diene]dibromidopalladium(II)
• Authors of publication: Kim, Nam-Ho; Ha, Kwang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 7
• Pages of publication: m727
• a: 12.758 ± 0.002 Å
• b: 7.4313 ± 0.0011 Å
• c: 9.0138 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 854.6 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0564
• Residual factor for significantly intense reflections: 0.0258
• Weighted residual factors for significantly intense reflections: 0.0526
• Weighted residual factors for all reflections included in the refinement: 0.0711
• Goodness-of-fit parameter for all reflections included in the refinement: 0.989
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes