Information card for entry 4071296

Structure parameters

• Formula: C76 H108 N8 Ni O4 Sn4
• Calculated formula: C76 H108 N8 Ni O4 Sn4
• SMILES: C1COCC1.C1OCCC1.[Sn]12N(c3c(N2Cc2cccc(CN4[Sn]([Ni]51[Sn]1(N(c6c(N1CC(C)(C)C)cccc6)Cc1cccc(c1)CN1[Sn]5N(c5ccccc15)CC(C)(C)C)[O]1CCCC1)N(c1ccccc41)CC(C)(C)C)c2)cccc3)CC(C)(C)C.O1CCCC1
• Title of publication: Homoleptic Complexes of Bisstannylenes with Nickel(0): Synthesis, X-Ray Diffraction Studies, and119Sn NMR Investigations
• Authors of publication: Zabula, Alexander V.; Pape, Tania; Hepp, Alexander; Hahn, F. Ekkehardt
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 12
• Pages of publication: 2756
• a: 13.673 ± 0.004 Å
• b: 15.729 ± 0.004 Å
• c: 18.926 ± 0.005 Å
• α: 113.997 ± 0.005°
• β: 90.057 ± 0.005°
• γ: 94.065 ± 0.005°
• Cell volume: 3707.1 ± 1.7 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.11
• Residual factor for significantly intense reflections: 0.0725
• Weighted residual factors for significantly intense reflections: 0.172
• Weighted residual factors for all reflections included in the refinement: 0.1922
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No