Information card for entry 4320429

Structure parameters

• Formula: C26 H60 N6 S2 Zn
• Calculated formula: C26 H60 N6 S2 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: 17.904 ± 0.004 Å
• b: 8.7848 ± 0.0018 Å
• c: 21.204 ± 0.004 Å
• α: 90°
• β: 98.4 ± 0.03°
• γ: 90°
• Cell volume: 3299.3 ± 1.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.061
• Residual factor for significantly intense reflections: 0.0322
• Weighted residual factors for significantly intense reflections: 0.0653
• Weighted residual factors for all reflections included in the refinement: 0.0711
• Goodness-of-fit parameter for all reflections included in the refinement: 0.839
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No