Information card for entry 2100896

Structure parameters

• Formula: C16 H16 N2 O4
• Calculated formula: C16 N2 O4
• SMILES: O=N(=O)[C@@](C)(c1ccccc1)[C@@](C)(N(=O)=O)c1ccccc1.O=N(=O)[C@](C)(c1ccccc1)[C@](C)(N(=O)=O)c1ccccc1
• Title of publication: Structures of <i>meso</i>- and (±)-1,2-dinitro-1,2-diphenylethane and 2,3-dinitro-2,3-diphenylbutane
• Authors of publication: Koh, L.-L.; Lam, Y.; Sim, K. Y.; Huang, H. H.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 1
• Pages of publication: 116 - 123
• a: 17.928 ± 0.005 Å
• b: 8.713 ± 0.002 Å
• c: 12.366 ± 0.004 Å
• α: 90°
• β: 129.14 ± 0.02°
• γ: 90°
• Cell volume: 1498.2 ± 0.8 ų
• Number of distinct elements: 4
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: Mo
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No