Information card for entry 4077024

Structure parameters

• Formula: C10 H20 Cl2 N2 Pd
• Calculated formula: C10 H20 Cl2 N2 Pd
• SMILES: [Pd]1(Cl)(Cl)[N]2(CCC[C@@H]3[N]1(CCC[C@H]23)C)C.[Pd]1(Cl)(Cl)[N]2(CCC[C@H]3[N]1(CCC[C@@H]23)C)C
• Title of publication: Copper(II) Complexes of Novel 1,5-Diaza-cis-decalin Diamine Ligands: An Investigation of Structure and Reactivity
• Authors of publication: Kozlowski, Marisa C.; Li, Xiaolin; Carroll, Patrick J.; Xu, Zhenrong
• Journal of publication: Organometallics
• Year of publication: 2002
• Journal volume: 21
• Journal issue: 21
• Pages of publication: 4513
• a: 8.1492 ± 0.0001 Å
• b: 12.7481 ± 0.0002 Å
• c: 24.4944 ± 0.0004 Å
• α: 90°
• β: 91.29 ± 0.001°
• γ: 90°
• Cell volume: 2544 ± 0.07 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0423
• Residual factor for significantly intense reflections: 0.0406
• Weighted residual factors for all reflections: 0.1104
• Weighted residual factors for significantly intense reflections: 0.1088
• Goodness-of-fit parameter for all reflections: 1.11
• Goodness-of-fit parameter for significantly intense reflections: 1.113
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No