Information card for entry 4320430

Structure parameters

• Formula: C23 H52 Li N3 O2 S Zn
• Calculated formula: C23 H52 Li N3 O2 S Zn
• 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: 10.765 ± 0.0007 Å
• b: 17.6396 ± 0.0012 Å
• c: 15.3456 ± 0.0011 Å
• α: 90°
• β: 93.372 ± 0.001°
• γ: 90°
• Cell volume: 2908.9 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0504
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.1025
• Weighted residual factors for all reflections included in the refinement: 0.1074
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No