Information card for entry 2215860

Structure parameters

• Chemical name: N'-(Diphenylmethylene)-3-(3-nitrophenyl)-1',3'-dioxospiro[cyclopropane-2'- indan]-2-carbohydrazide
• Formula: C31 H21 N3 O5
• Calculated formula: C31 H21 N3 O5
• SMILES: O=C1C2([C@@H](c3cccc(N(=O)=O)c3)[C@H]2C(=O)N/N=C(/c2ccccc2)c2ccccc2)C(=O)c2ccccc12.O=C1C2([C@H](c3cccc(N(=O)=O)c3)[C@@H]2C(=O)N/N=C(/c2ccccc2)c2ccccc2)C(=O)c2ccccc12
• Title of publication: <i>N</i>'-(Diphenylmethylene)-3-(3-nitrophenyl)-1',3'-dioxospiro[cyclopropane-2'-indan]-2-carbohydrazide
• Authors of publication: G. Chakkaravarthi; G. Periyasamy; R. Raghunathan; V. Manivannan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 11
• Pages of publication: o4290 - o4290
• a: 9.4617 ± 0.0004 Å
• b: 12.8806 ± 0.0005 Å
• c: 12.9114 ± 0.0008 Å
• α: 108.212 ± 0.002°
• β: 108.535 ± 0.003°
• γ: 107.424 ± 0.002°
• Cell volume: 1270.69 ± 0.12 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0588
• Residual factor for significantly intense reflections: 0.0441
• Weighted residual factors for significantly intense reflections: 0.1119
• Weighted residual factors for all reflections included in the refinement: 0.122
• 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: Yes