Information card for entry 4319012

Structure parameters

• Formula: C64 H112 Li8 N8 O6 P4
• Calculated formula: C64 H112 Li8 N8 O6 P4
• Title of publication: Synthesis and X-ray Structures of Dilithium Complexes of the Phosphonate Anions [PhP(E)(NtBu)2]2- (E = O, S, Se, Te) and Dimethylaluminum Derivatives of [PhP(E)(NtBu)(NHtBu)]- (E = S, Se)
• Authors of publication: Glen G. Briand; Tristram Chivers; Mark Krahn; Masood Parvez
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 6808 - 6815
• a: 16.9725 ± 0.0003 Å
• b: 20.8445 ± 0.0003 Å
• c: 21.5041 ± 0.0004 Å
• α: 90°
• β: 94.66 ± 0.0006°
• γ: 90°
• Cell volume: 7582.6 ± 0.2 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.0875
• Residual factor for significantly intense reflections: 0.0528
• Weighted residual factors for significantly intense reflections: 0.13
• Weighted residual factors for all reflections included in the refinement: 0.1501
• Goodness-of-fit parameter for all reflections included in the refinement: 0.995
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No