Information card for entry 4116673

Structure parameters

• Formula: C30 H54 Hg Si2
• Calculated formula: C30 H54 Hg Si2
• SMILES: [Hg](C1(C(=C(C(=C1C)C)C)C)[Si](C)(C)C(C)(C)C)C1(C(=C(C(=C1C)C)C)C)[Si](C)(C)C(C)(C)C
• Title of publication: Mercurycyclopentadienyl Derivatives Are Not Always Fluxional
• Authors of publication: Peter B. Hitchcock; Julian M. Keates; Gerard A. Lawless
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 1998
• Journal volume: 120
• Pages of publication: 599 - 600
• a: 8.744 ± 0.004 Å
• b: 8.769 ± 0.006 Å
• c: 11.136 ± 0.004 Å
• α: 80.72 ± 0.04°
• β: 76.59 ± 0.03°
• γ: 76.23 ± 0.05°
• Cell volume: 801.6 ± 0.7 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0218
• Residual factor for significantly intense reflections: 0.0218
• Weighted residual factors for all reflections: 0.0554
• Weighted residual factors for significantly intense reflections: 0.0554
• Goodness-of-fit parameter for all reflections: 1.018
• Goodness-of-fit parameter for significantly intense reflections: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No