Information card for entry 1571636

Structure parameters

• Formula: C30 H28 O6
• Calculated formula: C30 H28 O6
• Title of publication: Surface coating induced room-temperature phosphorescence in flexible organic single crystals.
• Authors of publication: Samadder, Prodipta; Naim, Khalid; Sahoo, Subash Chandra; Neelakandan, Prakash P.
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 15
• Journal issue: 24
• Pages of publication: 9258 - 9265
• a: 9.5504 ± 0.0004 Å
• b: 9.6216 ± 0.0004 Å
• c: 14.9202 ± 0.0005 Å
• α: 76.429 ± 0.003°
• β: 78.195 ± 0.003°
• γ: 70.242 ± 0.004°
• Cell volume: 1242.47 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0785
• Residual factor for significantly intense reflections: 0.0487
• Weighted residual factors for significantly intense reflections: 0.1127
• Weighted residual factors for all reflections included in the refinement: 0.1303
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No