Information card for entry 7704531

Structure parameters

• Formula: C44 H46 B Br Mo N6 O2 P2 Pt
• Calculated formula: C44 H46 B Br Mo N6 O2 P2 Pt
• SMILES: [Pt]1(Br)([P](c2ccccc2)(CC[P]1(c1ccccc1)c1ccccc1)c1ccccc1)C#[Mo]12([n]3n(c(C)cc3C)[BH](n3[n]2c(C)cc3C)n2[n]1c(cc2C)C)(C#[O])C#[O]
• Title of publication: Heterobimetallic μ₂-carbido complexes of platinum and tungsten.
• Authors of publication: Burt, Liam K.; Hill, Anthony F.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 24
• Pages of publication: 8143 - 8161
• a: 42.7794 ± 0.0012 Å
• b: 10.397 ± 0.0003 Å
• c: 20.4764 ± 0.0007 Å
• α: 90°
• β: 94.581 ± 0.003°
• γ: 90°
• Cell volume: 9078.3 ± 0.5 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 9
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0564
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.0875
• Weighted residual factors for all reflections included in the refinement: 0.0929
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No