Information card for entry 4063734

Structure parameters

• Formula: C36 H37 B Mo N6 O2 Pb
• Calculated formula: C36 H37 B Mo N6 O2 Pb
• SMILES: C([Pb](c1ccccc1)(c1ccccc1)c1ccccc1)#[Mo]12(C#[O])(C#[O])[n]3n([BH](n4[n]1c(cc4C)C)n1[n]2c(cc1C)C)c(cc3C)C
• Title of publication: Group 14 Substituted Carbyne Complexes—An Almost Complete Set: [Mo(\τb CAPh3)(CO)2(Tp*)] (Tp* = Hydrotris(dimethylpyrazolyl)borate; A = Si, Ge, Sn, Pb but A ≠ C)
• Authors of publication: Cordiner, Richard L.; Hill, Anthony F.; Shang, Rong; Willis, Anthony C.
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 1
• Pages of publication: 139
• a: 15.4068 ± 0.0002 Å
• b: 15.9388 ± 0.0003 Å
• c: 14.5102 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3563.21 ± 0.11 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 7
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0437
• Residual factor for significantly intense reflections: 0.0332
• Weighted residual factors for all reflections: 0.1116
• Weighted residual factors for significantly intense reflections: 0.088
• Weighted residual factors for all reflections included in the refinement: 0.1116
• Goodness-of-fit parameter for all reflections included in the refinement: 0.8814
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No