Information card for entry 4328284

Structure parameters

• Formula: C30 H58 Ni O Sn3
• Calculated formula: C30 H58 Ni O Sn3
• SMILES: [Ni]12345(C#[O])[c]6([cH]1[cH]2[cH]3[cH]46)[Sn]([Sn]([Sn]5(C(C)(C)C)C(C)(C)C)(C(C)(C)C)C(C)(C)C)(C(C)(C)C)C(C)(C)C
• Title of publication: Synthesis and Structure of Distanna and Tristanna Ansa Half-Sandwich Complexes of Ruthenium and Nickel
• Authors of publication: Holger Braunschweig; Rainer Dörfler; Kai Hammond; Thomas Kramer; Jan Mies; Krzysztof Radacki; Marius Schäfer
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 1225 - 1227
• a: 10.8423 ± 0.0006 Å
• b: 11.1459 ± 0.0006 Å
• c: 17.0318 ± 0.0009 Å
• α: 102.351 ± 0.002°
• β: 107.504 ± 0.002°
• γ: 93.868 ± 0.002°
• Cell volume: 1898.22 ± 0.18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.021
• Residual factor for significantly intense reflections: 0.0187
• Weighted residual factors for significantly intense reflections: 0.0581
• Weighted residual factors for all reflections included in the refinement: 0.0593
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No