Information card for entry 4315198

Structure parameters

• Formula: C14 H24 Cl2 N4 Pd
• Calculated formula: C14 H24 Cl2 N4 Pd
• SMILES: CCN1C(=[Pd](Cl)(=C2N(C=CN2CC)CC)Cl)N(C=C1)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: 10.1228 ± 0.0002 Å
• b: 11.1158 ± 0.0002 Å
• c: 15.4894 ± 0.0003 Å
• α: 90°
• β: 91.205 ± 0.002°
• γ: 90°
• Cell volume: 1742.53 ± 0.06 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0309
• Residual factor for significantly intense reflections: 0.0266
• Weighted residual factors for significantly intense reflections: 0.0914
• Weighted residual factors for all reflections included in the refinement: 0.0945
• Goodness-of-fit parameter for all reflections included in the refinement: 0.807
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No