Information card for entry 2001307

Structure parameters

• Chemical name: 6,6a,7,11b-Tetrahydro-6a-methyl-5-phenyl-5,7-methano-5H- benzo[c]fluorene
• Formula: C25 H22
• Calculated formula: C25 H22
• SMILES: c1cccc2[C@]3(C[C@@]4([C@@H](c5ccccc5[C@@H]4c12)C3)C)c1ccccc1.c1cccc2[C@@]3(C[C@]4([C@H](c5ccccc5[C@H]4c12)C3)C)c1ccccc1
• Title of publication: 6,6a,7,11b-Tetrahydro-6a-methyl-5-phenyl-5,7-methano-5<i>H</i>-benzo[<i>c</i>]fluorene and 9-methyl-1,3,9-triphenylfluorene
• Authors of publication: Sullins, D. W.; Holt, E. M.; Eisenbraun, E. J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 10
• Pages of publication: 1783 - 1786
• a: 12.478 ± 0.001 Å
• b: 6.223 ± 0.001 Å
• c: 23.024 ± 0.011 Å
• α: 90°
• β: 96.36 ± 0.03°
• γ: 90°
• Cell volume: 1776.8 ± 0.9 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 2
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Goodness-of-fit parameter for significantly intense reflections: 1.12
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No