Information card for entry 2221182

Structure parameters

• Formula: C36 H25 N O3
• Calculated formula: C36 H25 N O3
• SMILES: O1c2c(C3(C(N(C3=O)c3ccccc3OC)c3c4ccccc4cc4ccccc34)c3c1cccc3)cccc2
• Title of publication: 4-(9-Anthryl)-1-(2-methoxyphenyl)spiro[azetidin-3,9'-xanthen]-2-one
• Authors of publication: Yalçın, Şerife Pınar; Akkurt, Mehmet; Jarrahpour, Aliasghar; Ebrahimi, Edris; Büyükgüngör, Orhan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 3
• Pages of publication: o626 - o627
• a: 11.8496 ± 0.0003 Å
• b: 15.3168 ± 0.0005 Å
• c: 14.9883 ± 0.0004 Å
• α: 90°
• β: 106.536 ± 0.002°
• γ: 90°
• Cell volume: 2607.84 ± 0.13 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 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: 0.0555
• Residual factor for significantly intense reflections: 0.0408
• Weighted residual factors for significantly intense reflections: 0.0987
• Weighted residual factors for all reflections included in the refinement: 0.1058
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes