Information card for entry 7719588

Structure parameters

• Formula: C12 H18 B10
• Calculated formula: C12 H18 B10
• Title of publication: Photophysical studies on <i>meta</i>- and <i>para</i>-carboranes containing 1-naphthyl groups.
• Authors of publication: Harder, Rachel A.; McGurrell, Thomas D.; MacBride, J. A. Hugh; Böhling, Lena; Brockhinke, Andreas; Yufit, Dmitry S.; Fox, Mark A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 43
• Pages of publication: 16037 - 16048
• a: 26.161 ± 0.0006 Å
• b: 7.1572 ± 0.0002 Å
• c: 7.8465 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1469.17 ± 0.06 ų
• Cell temperature: 120.15 K
• Ambient diffraction temperature: 120.15 K
• Number of distinct elements: 3
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0415
• Residual factor for significantly intense reflections: 0.0368
• Weighted residual factors for significantly intense reflections: 0.0924
• Weighted residual factors for all reflections included in the refinement: 0.096
• Goodness-of-fit parameter for all reflections included in the refinement: 0.997
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No