Information card for entry 2000756

Structure parameters

• Chemical name: N-benzyl-3-benzylidene-4-methyl-4-nitro-5-phenyl-2-pyrrolidinone
• Formula: C25 H22 N2 O3
• Calculated formula: C25 H22 N2 O3
• SMILES: C1(=O)/C(=C/c2ccccc2)[C@]([C@@H](c2ccccc2)N1Cc1ccccc1)(C)N(=O)=O.C1(=O)/C(=C/c2ccccc2)[C@@]([C@H](c2ccccc2)N1Cc1ccccc1)(C)N(=O)=O
• Title of publication: Structure of <i>N</i>-benzyl-3-benzylidene-4-methyl-4-nitro-5-phenyl-2-pyrrolidinone
• Authors of publication: Mostafa, G.; Mukherjee, M.; Ray, S.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1992
• Journal volume: 48
• Journal issue: 7
• Pages of publication: 1241 - 1243
• a: 9.385 ± 0.004 Å
• b: 12.314 ± 0.004 Å
• c: 18.573 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2146.4 ± 1.3 ų
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P b n 21
• Hall space group symbol: P 2c -2ab
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: Mo
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No