Information card for entry 7134195

Structure parameters

• Formula: C18 H18 N2 O4 S2
• Calculated formula: C18 H18 N2 O4 S2
• Title of publication: Rhodium/selenium dual catalysis for accessing 2-aminopyrroles from <i>N</i>-sulfonyl-1,2,3-triazoles.
• Authors of publication: Pal, Kuntal; Dash, Om Prakash; Volla, Chandra M. R.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 19
• Pages of publication: 3872 - 3875
• a: 9.0198 ± 0.0004 Å
• b: 9.8165 ± 0.0004 Å
• c: 11.3146 ± 0.0004 Å
• α: 89.792 ± 0.003°
• β: 89.757 ± 0.003°
• γ: 63.581 ± 0.004°
• Cell volume: 897.19 ± 0.07 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0399
• Residual factor for significantly intense reflections: 0.0352
• Weighted residual factors for significantly intense reflections: 0.0925
• Weighted residual factors for all reflections included in the refinement: 0.0966
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No