Information card for entry 4320428

Structure parameters

• Formula: C15 H36 Al N3 S
• Calculated formula: C15 H36 Al N3 S
• Title of publication: Triimidosulfonic Acid and Organometallic Triimidosulfonates: S+N- versus SN Bonding
• Authors of publication: Bernhard Walfort; Angela P. Leedham; Christopher A. Russell; Dietmar Stalke
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 5668 - 5674
• a: 10.642 ± 0.002 Å
• b: 16.447 ± 0.003 Å
• c: 23.441 ± 0.005 Å
• α: 90 ± 0.03°
• β: 92.39 ± 0.03°
• γ: 90 ± 0.03°
• Cell volume: 4099.3 ± 1.4 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: 0.074
• Residual factor for significantly intense reflections: 0.0357
• Weighted residual factors for significantly intense reflections: 0.0809
• Weighted residual factors for all reflections included in the refinement: 0.091
• Goodness-of-fit parameter for all reflections included in the refinement: 0.847
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No