Information card for entry 7155305

Structure parameters

• Common name: Fused Indeno Pyridine
• Chemical name: 1-(1-phenyl-3-p-tolyl-1H-indeno[2,1-c]pyridin-2(9H)-yl)ethanone
• Formula: C27 H23 N O
• Calculated formula: C27 H23 N O
• SMILES: O=C(N1C(=CC2=C(C1c1ccccc1)Cc1c2cccc1)c1ccc(cc1)C)C
• Title of publication: BF3·Et2O mediated one-step synthesis of N-substituted-1,2-dihydropyridines, indenopyridines and 5,6-dihydroisoquinolines.
• Authors of publication: Fathimath Salfeena, C. T.; Ashitha, K. T.; Sasidhar, B. S.
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2016
• Journal volume: 14
• Journal issue: 43
• Pages of publication: 10165 - 10169
• a: 11.799 ± 0.008 Å
• b: 10.489 ± 0.006 Å
• c: 17.066 ± 0.012 Å
• α: 90°
• β: 105.461 ± 0.012°
• γ: 90°
• Cell volume: 2036 ± 2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1002
• Residual factor for significantly intense reflections: 0.0577
• Weighted residual factors for significantly intense reflections: 0.1312
• Weighted residual factors for all reflections included in the refinement: 0.151
• Goodness-of-fit parameter for all reflections included in the refinement: 0.731
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No