Information card for entry 7150125

Structure parameters

• Formula: C46 H38 O6
• Calculated formula: C46 H32 O6
• Title of publication: Methoxy-substituted centrohexaindanes through the fenestrane route.
• Authors of publication: Tellenbröker, Jörg; Barth, Dieter; Neumann, Beate; Stammler, Hans-Georg; Kuck, Dietmar
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2005
• Journal volume: 3
• Journal issue: 4
• Pages of publication: 570 - 571
• a: 17.357 ± 0.008 Å
• b: 13.487 ± 0.005 Å
• c: 14.83 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3472 ± 2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 3
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.1294
• Residual factor for significantly intense reflections: 0.0753
• Weighted residual factors for significantly intense reflections: 0.1787
• Weighted residual factors for all reflections included in the refinement: 0.2126
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No