Information card for entry 7132949

Structure parameters

• Common name: TTM-1CN
• Chemical name: BnBTM
• Formula: C20 H6 Cl8 N
• Calculated formula: C19.9999 H6 Cl8.0001 N0.9999
• Title of publication: Cyano modified triphenylmethyl radical skeletons: higher stability and efficiency.
• Authors of publication: Lv, Kuo; Zhang, Minzhe; Xia, Xin; Liu, Wenjing; Wan, Keke; Zhang, Ming; Li, Feng
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 36
• Pages of publication: 4846 - 4849
• a: 14.0305 ± 0.0009 Å
• b: 8.0731 ± 0.0005 Å
• c: 18.9296 ± 0.0012 Å
• α: 90°
• β: 94.608 ± 0.002°
• γ: 90°
• Cell volume: 2137.2 ± 0.2 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0684
• Residual factor for significantly intense reflections: 0.0582
• Weighted residual factors for significantly intense reflections: 0.1252
• Weighted residual factors for all reflections included in the refinement: 0.1312
• Goodness-of-fit parameter for all reflections included in the refinement: 1.148
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No