Information card for entry 7135935

Structure parameters

• Common name: Mono-selenylated arylamide
• Chemical name: SM-761
• Formula: C13 H10 Cl N O Se
• Calculated formula: C13 H10 Cl N O Se
• Title of publication: Additive Controlled Switchable Mono-vs. Di-Selenylation of Primary Arylamides via Ru(II) Catalyzed C-H activation
• Authors of publication: Mishra, Saksham; Kumar, Amit
• Journal of publication: Chemical Communications
• Year of publication: 2026
• a: 5.2679 ± 0.0002 Å
• b: 10.7453 ± 0.0005 Å
• c: 22.8596 ± 0.001 Å
• α: 90°
• β: 93.002 ± 0.002°
• γ: 90°
• Cell volume: 1292.2 ± 0.1 ų
• Cell temperature: 273.15 K
• Ambient diffraction temperature: 273.15 K
• Number of distinct elements: 6
• 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: 0.0862
• Residual factor for significantly intense reflections: 0.0436
• Weighted residual factors for significantly intense reflections: 0.1293
• Weighted residual factors for all reflections included in the refinement: 0.1759
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No