Information card for entry 1507036

Structure parameters

• Formula: C55 H57 N O7
• Calculated formula: C55 H57 N O7
• SMILES: O1c2c3Cc4cccc(Cc5c(OCCOCCOCCOCC1)c(Cc1c(OCC)c(cc(NCc6c7ccccc7cc7ccccc67)c1)Cc2ccc3)ccc5)c4OCC
• Title of publication: New fluorescence-quenching process through resumption of PET process induced by complexation of alkali metal ion.
• Authors of publication: Bu, Jian-Hua; Zheng, Qi-Yu; Chen, Chuan-Feng; Huang, Zhi-Tang
• Journal of publication: Organic letters
• Year of publication: 2004
• Journal volume: 6
• Journal issue: 19
• Pages of publication: 3301 - 3303
• a: 13.815 ± 0.004 Å
• b: 30.518 ± 0.009 Å
• c: 11.346 ± 0.004 Å
• α: 90°
• β: 109.457 ± 0.006°
• γ: 90°
• Cell volume: 4510 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.2026
• Residual factor for significantly intense reflections: 0.0794
• Weighted residual factors for significantly intense reflections: 0.1723
• Weighted residual factors for all reflections included in the refinement: 0.2152
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No