Information card for entry 4315196

Structure parameters

• Formula: C14 H28 Cl2 N4 Pd
• Calculated formula: C14 H28 Cl2 N4 Pd
• SMILES: CCN1C(=[Pd](Cl)(=C2N(CCN2CC)CC)Cl)N(CC1)CC
• Title of publication: Biscarbene Palladium(II) Complexes. Reactivity of Saturated Versus Unsaturated N-Heterocyclic Carbenes
• Authors of publication: Ching-Feng Fu; Chun-Chin Lee; Yi-Hung Liu; Shie-Ming Peng; Stefan Warsink; Cornelis J. Elsevier; Jwu-Ting Chen; Shiuh-Tzung Liu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 3011 - 3018
• a: 10.0204 ± 0.0003 Å
• b: 11.0892 ± 0.0003 Å
• c: 16.3857 ± 0.0005 Å
• α: 90°
• β: 94.36 ± 0.003°
• γ: 90°
• Cell volume: 1815.48 ± 0.09 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0416
• Residual factor for significantly intense reflections: 0.0386
• Weighted residual factors for significantly intense reflections: 0.1029
• Weighted residual factors for all reflections included in the refinement: 0.1049
• Goodness-of-fit parameter for all reflections included in the refinement: 0.886
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No