Information card for entry 7003212

Structure parameters

• Formula: C28 H62 Cs O P3 Si2
• Calculated formula: C28 H62 Cs O P3 Si2
• SMILES: C(C)(C)([Si](C(C)(C)C)(P=P[P-][Si](C(C)(C)C)(C(C)(C)C)C(C)(C)C)C(C)(C)C)C.[Cs+].C1CCCO1
• Title of publication: Isoelectronic caesium compounds: the triphosphenide Cs[tBu3SiPPPSitBu3] and the enolate Cs[OCHCH2]
• Authors of publication: Lerner, Hans-Wolfram; Sänger, Inge; Schödel, Frauke; Lorbach, Andreas; Bolte, Michael; Wagner, Matthias
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 6
• Pages of publication: 787 - 792
• a: 25.516 ± 0.002 Å
• b: 12.8382 ± 0.0011 Å
• c: 11.8824 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3892.4 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 63
• Hermann-Mauguin space group symbol: C m c m
• Hall space group symbol: -C 2c 2
• Residual factor for all reflections: 0.0974
• Residual factor for significantly intense reflections: 0.0941
• Weighted residual factors for significantly intense reflections: 0.2203
• Weighted residual factors for all reflections included in the refinement: 0.2228
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No