Information card for entry 7102471

Structure parameters

• Common name: Mo complex
• Formula: C51 H80 Ge Mo O6 Si6
• Calculated formula: C51 H80 Ge Mo O6 Si6
• SMILES: [Ge]1(c2ccccc2C(O1)=[Mo](C#[O])(C#[O])(C#[O])(C#[O])C#[O])(c1c(cc(cc1C([Si](C)(C)C)[Si](C)(C)C)C([Si](C)(C)C)[Si](C)(C)C)C([Si](C)(C)C)[Si](C)(C)C)c1c(cccc1C(C)C)C(C)C
• Title of publication: Thermal reactions of an overcrowded germacyclopropabenzene with group 6 metal hexacarbonyl complexes [M(CO)6](M = Cr, Mo, and W): a novel mode of CO insertion leading to the formation of cyclic germoxycarbene metal complexes.
• Authors of publication: Tajima, Tomoyuki; Sasaki, Takayo; Sasamori, Takahiro; Takeda, Nobuhiro; Tokitoh, Norihiro
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2004
• Journal issue: 4
• Pages of publication: 402 - 403
• a: 11.911 ± 0.005 Å
• b: 13.826 ± 0.006 Å
• c: 19.818 ± 0.008 Å
• α: 77.247 ± 0.012°
• β: 71.363 ± 0.011°
• γ: 84.446 ± 0.014°
• Cell volume: 3015 ± 2 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 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: 0.098
• Residual factor for significantly intense reflections: 0.0688
• Weighted residual factors for significantly intense reflections: 0.1623
• Weighted residual factors for all reflections included in the refinement: 0.1783
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No