Information card for entry 7248681

Structure parameters

• Formula: C26 H29 Cl2 F13 N2 O4
• Calculated formula: C26 H29 Cl2 F13 N2 O4
• Title of publication: New melphalan derivatives for the treatment of retinoblastoma in combination with thermotherapy
• Authors of publication: Zebret, Soumaila; Hadiji, Mouna; Romano-deGea, Jan; Bornet, Aurélien; Ortiz, Daniel; Fadaei Tirani, Farzaneh; Stathopoulos, Christina; Nowak-Sliwinska, Patrycja; Munier, Francis; Dyson, Paul Joseph
• Journal of publication: RSC Medicinal Chemistry
• Year of publication: 2024
• a: 10.979 ± 0.0002 Å
• b: 30.0354 ± 0.0005 Å
• c: 9.7195 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3205.09 ± 0.1 ų
• Cell temperature: 140.01 ± 0.1 K
• Ambient diffraction temperature: 140.01 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0426
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.0912
• Weighted residual factors for all reflections included in the refinement: 0.0961
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No