Information card for entry 4073377

Structure parameters

• Formula: C35 H53 Ga N2 Ni2
• Calculated formula: C35 H53 Ga N2 Ni2
• SMILES: [Ga]12([Ni]345([Ni]61([CH2]3C4)[CH2]=[CH2]6)[CH2]=[CH2]5)N(C(=CC(C)=[N]2c1c(C(C)C)cccc1C(C)C)C)c1c(cccc1C(C)C)C(C)C
• Title of publication: Nickel Olefin Complexes Supported by GaI(DDP)†
• Authors of publication: Kempter, Andreas; Gemel, Christian; Cadenbach, Thomas; Fischer, Roland A.
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 17
• Pages of publication: 4257
• a: 11.107 ± 0.004 Å
• b: 11.538 ± 0.004 Å
• c: 13.631 ± 0.005 Å
• α: 87.64 ± 0.03°
• β: 80.73 ± 0.03°
• γ: 76.94 ± 0.03°
• Cell volume: 1679.4 ± 1.1 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1311
• Residual factor for significantly intense reflections: 0.0461
• Weighted residual factors for significantly intense reflections: 0.0521
• Weighted residual factors for all reflections included in the refinement: 0.066
• Goodness-of-fit parameter for all reflections included in the refinement: 0.703
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No