Information card for entry 2228411

Structure parameters

• Common name: 3-Ferrocenyl-3,3a,5,9b,10,10a,11,12- octahydrofuro[3,4-<i>c</i>]pyrrolizino[2,\3-<i>c</i>]quinoline-1,4-dione
• Chemical name: 19-Ferrocenyl-18-oxa-8,16- diazapentacyclo[8.6.3.0^1,10^.0^2,7^.0^12,16^]nonadeca- 2(7),3,5-triene-9,17-dione
• Formula: C26 H24 Fe N2 O3
• Calculated formula: C26 H24 Fe N2 O3
• Title of publication: 19-Ferrocenyl-18-oxa-8,16-diazapentacyclo[8.6.3.0^1,10^.0^2,7^.0^12,16^]nonadeca-2(7),3,5-triene-9,17-dione
• Authors of publication: Gunasekaran, B.; Kathiravan, S.; Raghunathan, R.; Manivannan, V.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 12
• Pages of publication: m1543
• a: 9.6486 ± 0.0007 Å
• b: 18.89 ± 0.0013 Å
• c: 11.8207 ± 0.0009 Å
• α: 90°
• β: 93.248 ± 0.005°
• γ: 90°
• Cell volume: 2151 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• 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: 0.0847
• Residual factor for significantly intense reflections: 0.0439
• Weighted residual factors for significantly intense reflections: 0.1042
• Weighted residual factors for all reflections included in the refinement: 0.1234
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes