Information card for entry 2212889

Structure parameters

• Chemical name: {μ~4~-3,3'-Bi[tricyclo[2.2.1.0^2,6^]heptaphosphane](4-)}tetrakis[bis(1,2- dimethoxyethane)sodium(I)]
• Formula: C32 H80 Na4 O16 P14
• Calculated formula: C32 H80 Na4 O16 P14
• SMILES: P12P3[P-]P(P1P1P4P5[P-]P1[P-]P45)[P-]P23.[Na]12([O](C)CC[O]1C)[O](C)CC[O]2C.[Na]12([O](C)CC[O]1C)[O](C)CC[O]2C.[Na]12([O](C)CC[O]1C)[O](C)CC[O]2C.[Na]12([O](C)CC[O]1C)[O](C)CC[O]2C
• Title of publication: {μ~4~-3,3'-Bi[tricyclo[2.2.1.0^2,6^]heptaphosphane](4{-})}tetrakis[bis(1,2-dimethoxyethane)sodium(I)]
• Authors of publication: Lerner, Hans-Wolfram; Bolte, Michael
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 4
• Pages of publication: m1013 - m1014
• a: 12.444 ± 0.002 Å
• b: 20.264 ± 0.003 Å
• c: 12.874 ± 0.002 Å
• α: 90°
• β: 101.32 ± 0.01°
• γ: 90°
• Cell volume: 3183.2 ± 0.9 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1679
• Residual factor for significantly intense reflections: 0.0682
• Weighted residual factors for significantly intense reflections: 0.0964
• Weighted residual factors for all reflections included in the refinement: 0.1222
• Goodness-of-fit parameter for all reflections included in the refinement: 0.892
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes