Information card for entry 4323702

Structure parameters

• Formula: C38 H48 Cl2 In2 O4.5
• Calculated formula: C38.5 H60 Cl2 In2 O4
• Title of publication: Unusual Ring Systems Containing Indium. Synthesis and Structure of the First Mercuraindacycles
• Authors of publication: François P. Gabbaï; Annette Schier; Jürgen Riede; Alexander Sladek; Hans W. Görlitzer
• Journal of publication: Inorganic Chemistry
• Year of publication: 1997
• Journal volume: 36
• Pages of publication: 5694 - 5698
• a: 19.492 ± 0.001 Å
• b: 19.492 ± 0.001 Å
• c: 10.432 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3963.5 ± 0.5 ų
• Cell temperature: 199 K
• Ambient diffraction temperature: 199 K
• Number of distinct elements: 5
• Space group number: 85
• Hermann-Mauguin space group symbol: P 4/n :2
• Hall space group symbol: -P 4a
• Residual factor for all reflections: 0.0743
• Residual factor for significantly intense reflections: 0.0572
• Weighted residual factors for all reflections: 0.157
• Weighted residual factors for significantly intense reflections: 0.1312
• Goodness-of-fit parameter for all reflections: 1.231
• Goodness-of-fit parameter for significantly intense reflections: 1.298
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No