Information card for entry 7135752

Structure parameters

• Formula: C48 H40 O
• Calculated formula: C48 H40 O
• Title of publication: Substituent-induced modulation of proaromaticity in benzo-fused fluorenophenalene exhibiting a low-lying LUMO.
• Authors of publication: Sahewal, Sakshi; Sharma, Suman; Mallick, Dibyendu; Das, Soumyajit
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2026
• Journal volume: 62
• Journal issue: 37
• Pages of publication: 9481 - 9485
• a: 9.0236 ± 0.0014 Å
• b: 16.688 ± 0.003 Å
• c: 26.51 ± 0.005 Å
• α: 96.376 ± 0.008°
• β: 93.001 ± 0.005°
• γ: 98.414 ± 0.005°
• Cell volume: 3915.1 ± 1.2 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1624
• Residual factor for significantly intense reflections: 0.0905
• Weighted residual factors for significantly intense reflections: 0.2061
• Weighted residual factors for all reflections included in the refinement: 0.2396
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No