Information card for entry 1568235

Structure parameters

• Formula: C48 H42 S6
• Calculated formula: C48 H42 S6
• Title of publication: Making multi-twisted luminophores produce persistent room-temperature phosphorescence.
• Authors of publication: Shen, Shen; Baryshnikov, Glib V.; Xie, Qishan; Wu, Bin; Lv, Meng; Sun, Hao; Li, Zhongyu; Ågren, Hans; Chen, Jinquan; Zhu, Liangliang
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 4
• Pages of publication: 970 - 978
• a: 12.4505 ± 0.0005 Å
• b: 14.978 ± 0.0006 Å
• c: 21.6769 ± 0.0008 Å
• α: 92.868 ± 0.002°
• β: 98.081 ± 0.001°
• γ: 91.753 ± 0.001°
• Cell volume: 3994.3 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.051
• Residual factor for significantly intense reflections: 0.0423
• Weighted residual factors for significantly intense reflections: 0.1052
• Weighted residual factors for all reflections included in the refinement: 0.1118
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 1.34138 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No