Information card for entry 4315508

Structure parameters

• Common name: 2
• Formula: C30 H46 Li2 O4 P2 S4
• Calculated formula: C30 H46 Li2 O4 P2 S4
• Title of publication: Facile Synthesis of Bis(dichalcogenophosphinate)s and a Remarkable [Li8(OH)6]2+ Polyhedron
• Authors of publication: Robert P. Davies; M. Giovanna Martinelli; Laura Patel; Andrew J. P. White
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 4626 - 4631
• a: 28.56 ± 0.0007 Å
• b: 28.56 ± 0.0007 Å
• c: 12.207 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 8623 ± 0.4 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 6
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.1342
• Residual factor for significantly intense reflections: 0.0778
• Weighted residual factors for significantly intense reflections: 0.2023
• Weighted residual factors for all reflections included in the refinement: 0.2475
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No