Information card for entry 1543517

Structure parameters

• Formula: C20 H45 Ni P3 Zn2
• Calculated formula: C20 H45 Ni P3 Zn2
• SMILES: [Zn]12345([Zn]([Ni]1([P](C)(C)C)([P](C)(C)C)[P](C)(C)C)C)[c]1([c]2([c]3([c]4([c]51C)C)C)C)C
• Title of publication: Zn⋯Zn interactions at nickel and palladium centers
• Authors of publication: Freitag, Kerstin; Molon, Mariusz; Jerabek, Paul; Dilchert, Katharina; Rösler, Christoph; Seidel, Rüdiger W.; Gemel, Christian; Frenking, Gernot; Fischer, Roland A.
• Journal of publication: Chem. Sci.
• Year of publication: 2016
• Journal volume: 7
• Journal issue: 10
• Pages of publication: 6413
• a: 9.2494 ± 0.0004 Å
• b: 10.0833 ± 0.0004 Å
• c: 15.9728 ± 0.0006 Å
• α: 100.172 ± 0.003°
• β: 92.322 ± 0.003°
• γ: 109.339 ± 0.004°
• Cell volume: 1375.66 ± 0.1 ų
• Cell temperature: 107 ± 2 K
• Ambient diffraction temperature: 107 ± 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: 0.0407
• Residual factor for significantly intense reflections: 0.0348
• Weighted residual factors for significantly intense reflections: 0.0897
• Weighted residual factors for all reflections included in the refinement: 0.0961
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No