Information card for entry 7229299

Structure parameters

• Formula: C44 H62
• Calculated formula: C44 H62
• SMILES: c12cc3c(cc2c2ccccc2C1(CCCCCC)CCCCCC)C(c1c3cccc1)(CCCCCC)CCCCCC
• Title of publication: Molecular packing and morphological stability of dihydro-indeno[1,2-b]fluorenes in the context of their substitution pattern
• Authors of publication: Hempe, M.; Reggelin, M.
• Journal of publication: RSC Adv.
• Year of publication: 2017
• Journal volume: 7
• Journal issue: 75
• Pages of publication: 47183
• a: 8.453 ± 0.001 Å
• b: 10.868 ± 0.001 Å
• c: 11.903 ± 0.002 Å
• α: 92.85 ± 0.01°
• β: 108.07 ± 0.01°
• γ: 104.44 ± 0.01°
• Cell volume: 997.1 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 2
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0965
• Residual factor for significantly intense reflections: 0.0608
• Weighted residual factors for significantly intense reflections: 0.1356
• Weighted residual factors for all reflections included in the refinement: 0.1579
• Goodness-of-fit parameter for all reflections included in the refinement: 1.113
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No