Information card for entry 4070129

Structure parameters

• Formula: C36 H54 Bi Cl Hf N2 O Si2
• Calculated formula: C36 H54 Bi Cl Hf N2 O Si2
• SMILES: [Hf]12345678(Cl)(O[Bi]9N([Si](C)(C)C)c%10c%11c(N9[Si](C)(C)C)cccc%11ccc%10)([c]9([c]1([c]2([c]3([c]49C)C)C)C)C)[c]1([c]8([c]7([c]6([c]51C)C)C)C)C
• Title of publication: Synthesis and Structural Characterization of Heterobimetallic Bismuth Complexes with Main Group and Transition Metals
• Authors of publication: Nekoueishahraki, Bijan; Jana, Anukul; Roesky, Herbert W.; Mishra, Lallan; Stern, Daniel; Stalke, Dietmar
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 19
• Pages of publication: 5733
• a: 12.3404 ± 0.0014 Å
• b: 10.334 ± 0.0011 Å
• c: 15.7596 ± 0.0018 Å
• α: 90°
• β: 108.189 ± 0.001°
• γ: 90°
• Cell volume: 1909.3 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 n 1
• Hall space group symbol: P -2yac
• Residual factor for all reflections: 0.0251
• Residual factor for significantly intense reflections: 0.0245
• Weighted residual factors for significantly intense reflections: 0.0599
• Weighted residual factors for all reflections included in the refinement: 0.0604
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No