Information card for entry 7711147

Structure parameters

• Formula: C11 H16 I N O2
• Calculated formula: C11 H16 I N O2
• Title of publication: Carbonyl Hypoiodites from Pivalic and Trimesic Acid and their Silver(I) Intermediates
• Authors of publication: Ward, Jas S.; Martõnova, Jevgenija; Wilson, Laura M. E.; Kramer, Eric; Aav, Riina; Rissanen, Kari
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 5.6777 ± 0.0003 Å
• b: 8.6359 ± 0.0005 Å
• c: 13.1369 ± 0.0008 Å
• α: 76.766 ± 0.005°
• β: 78.689 ± 0.005°
• γ: 86.009 ± 0.004°
• Cell volume: 614.64 ± 0.06 ų
• Cell temperature: 119.98 ± 0.13 K
• Ambient diffraction temperature: 119.98 ± 0.13 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0415
• Residual factor for significantly intense reflections: 0.0355
• Weighted residual factors for significantly intense reflections: 0.062
• Weighted residual factors for all reflections included in the refinement: 0.0655
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No