Information card for entry 7245979

Structure parameters

• Formula: C19 H23 B F2 N2 O
• Calculated formula: C19 H23 B F2 N2 O
• Title of publication: External environment sensitive circularly polarized luminescence properties of a chiral boron difluoride complex
• Authors of publication: Ikeshita, Masahiro; He, Hongxi; Kitahara, Maho; Imai, Yoshitane; Tsuno, Takashi
• Journal of publication: RSC Advances
• Year of publication: 2022
• Journal volume: 12
• Journal issue: 53
• Pages of publication: 34790 - 34796
• a: 19.6617 ± 0.0011 Å
• b: 6.5542 ± 0.0004 Å
• c: 20.6217 ± 0.0011 Å
• α: 90°
• β: 100.086 ± 0.005°
• γ: 90°
• Cell volume: 2616.4 ± 0.3 ų
• Cell temperature: 113.15 K
• Ambient diffraction temperature: 113.15 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1213
• Residual factor for significantly intense reflections: 0.0461
• Weighted residual factors for significantly intense reflections: 0.1242
• Weighted residual factors for all reflections included in the refinement: 0.1626
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No