Information card for entry 7027963

Structure parameters

• Formula: C19.5 H37 Cl N2 P2 S4 Si3
• Calculated formula: C19.5 H37 Cl N2 P2 S4 Si3
• Title of publication: New P‒S‒N containing ring systems. Reaction of 2,4-(naphthalene-1,8-diyl)-1,3,2,4-dithiadiphosphetane 2,4-disulfide and its 4-methoxynaphthalene derivative with hexamethyldisilazane
• Authors of publication: Kilián, Petr; Marek, Jaromír; Marek, Radek; Tou·ín, Jiøí; Humpa, Otakar; Novosad, Josef; Woollins, J. Derek
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1998
• Journal issue: 7
• Pages of publication: 1175
• a: 17.698 ± 0.009 Å
• b: 12.841 ± 0.003 Å
• c: 14.008 ± 0.004 Å
• α: 90°
• β: 104.08 ± 0.04°
• γ: 90°
• Cell volume: 3088 ± 2 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 2 K
• Number of distinct elements: 7
• 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: 0.0484
• Residual factor for significantly intense reflections: 0.0402
• Weighted residual factors for significantly intense reflections: 0.1091
• Weighted residual factors for all reflections included in the refinement: 0.1143
• Goodness-of-fit parameter for all reflections included in the refinement: 0.98
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No