Information card for entry 1571470

Structure parameters

• Common name: Ethidium benzoate methanol monosolvate
• Chemical name: 8-Amino-5-ethyl-6-phenylphenanthridin-5-ium benzoate methanol monosolvate
• Formula: C29 H29 N3 O3
• Calculated formula: C29 H29 N3 O3
• Title of publication: Ethidium benzoate methanol monosolvate
• Authors of publication: Shimazaki, Runa; Sadakiyo, Masaaki
• Journal of publication: IUCrData
• Year of publication: 2024
• Journal volume: 9
• Journal issue: 4
• a: 22.0407 ± 0.0006 Å
• b: 12.4642 ± 0.0003 Å
• c: 18.0706 ± 0.0005 Å
• α: 90°
• β: 107.495 ± 0.001°
• γ: 90°
• Cell volume: 4734.7 ± 0.2 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0688
• Residual factor for significantly intense reflections: 0.0532
• Weighted residual factors for significantly intense reflections: 0.139
• Weighted residual factors for all reflections included in the refinement: 0.1504
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No