Information card for entry 4302587

Structure parameters

• Common name: TpiPr2ZnStBu
• Formula: C34 H53 B N6 S Zn
• Calculated formula: C34 H53 B N6 S Zn
• Title of publication: S-Nitrosothiol and Nitric Oxide Reactivity at Zinc Thiolates
• Authors of publication: Matthew S. Varonka; Timothy H. Warren
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 5605 - 5607
• a: 9.505 ± 0.0008 Å
• b: 12.0757 ± 0.001 Å
• c: 16.4731 ± 0.0014 Å
• α: 85.213 ± 0.001°
• β: 86.741 ± 0.002°
• γ: 77.036 ± 0.001°
• Cell volume: 1834.7 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1333
• Residual factor for significantly intense reflections: 0.0733
• Weighted residual factors for significantly intense reflections: 0.1949
• Weighted residual factors for all reflections included in the refinement: 0.2267
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No