Information card for entry 7060025

Structure parameters

• Formula: C28 H36 N2 O10 P2
• Calculated formula: C28 H36 N2 O10 P2
• Title of publication: Iodine catalyzed one-pot four component synthesis of coumarinyl phosphoramidates via sequential addition of reactants
• Authors of publication: Imrankhan, Mohammed; Shivashankar, Kalegowda
• Journal of publication: New Journal of Chemistry
• Year of publication: 2020
• Journal volume: 44
• Journal issue: 43
• Pages of publication: 18573 - 18578
• a: 7.4224 ± 0.0012 Å
• b: 14.193 ± 0.002 Å
• c: 17.094 ± 0.003 Å
• α: 99.987 ± 0.006°
• β: 100.884 ± 0.006°
• γ: 103.517 ± 0.006°
• Cell volume: 1674.2 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.1576
• Residual factor for significantly intense reflections: 0.1381
• Weighted residual factors for significantly intense reflections: 0.418
• Weighted residual factors for all reflections included in the refinement: 0.4399
• Goodness-of-fit parameter for all reflections included in the refinement: 1.949
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No