Information card for entry 2001425

Structure parameters

• Formula: C28 H20 N2 O2 S2
• Calculated formula: C28 H20 N2 O2 S2
• SMILES: O=C1N(Cc2c1cccc2)c1ccccc1SSc1ccccc1N1Cc2c(C1=O)cccc2
• Title of publication: Structure of <i>o</i>,<i>o</i>'-bis(1-oxo-2,3-dihydro-1<i>H</i>-2-benzopyrrol-2-yl)diphenyl disulfide
• Authors of publication: Fawcett, J.; Kemmitt, R. D. W.; Russell, D. R.; Serindag, O.; Gok, Y.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 8
• Pages of publication: 1434 - 1436
• a: 25.05 ± 0.03 Å
• b: 6.203 ± 0.002 Å
• c: 15.89 ± 0.02 Å
• α: 90°
• β: 109.6 ± 0.1°
• γ: 90°
• Cell volume: 2326 ± 4 ų
• Number of distinct elements: 5
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No