Information card for entry 4031155

Structure parameters

• Common name: Furopyrrole
• Formula: C38 H45 N O12 S
• Calculated formula: C38 H45 N O12 S
• SMILES: S(=O)(=O)(N1C(C(=O)OCC)([C@]2(O[C@H](C[C@]2([C@H]1c1ccccc1)C(=O)OCC)c1cc(OC)c(OC)cc1)OCC)C(=O)OCC)c1ccc(cc1)C.S(=O)(=O)(N1C(C(=O)OCC)([C@@]2(O[C@@H](C[C@@]2([C@@H]1c1ccccc1)C(=O)OCC)c1cc(OC)c(OC)cc1)OCC)C(=O)OCC)c1ccc(cc1)C
• Title of publication: Lewis Acid Catalyzed Annulation of Donor-Acceptor Cyclopropane and N-Tosylaziridinedicarboxylate: One-Step Synthesis of Functionalized 2H-Furo[2,3-c]pyrroles.
• Authors of publication: Ghosh, Asit; Pandey, Ashok Kumar; Banerjee, Prabal
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2015
• Journal volume: 80
• Journal issue: 14
• Pages of publication: 7235 - 7242
• a: 11.199 ± 0.0004 Å
• b: 12.1908 ± 0.0004 Å
• c: 15.6001 ± 0.0005 Å
• α: 84.885 ± 0.002°
• β: 73.475 ± 0.002°
• γ: 67.037 ± 0.001°
• Cell volume: 1879.46 ± 0.11 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0783
• Residual factor for significantly intense reflections: 0.0498
• Weighted residual factors for significantly intense reflections: 0.1164
• Weighted residual factors for all reflections included in the refinement: 0.1291
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No