Information card for entry 2004147

Structure parameters

• Common name: none
• Chemical name: 2'-Methoxy-5'-methoxycarbonylspiro[dihydroacridine-9(10H),4'-thiazoline]
• Formula: C18 H16 N2 O3 S
• Calculated formula: C18 H16 N2 O3 S
• SMILES: S1C(C2(N=C1OC)c1c(Nc3c2cccc3)cccc1)C(=O)OC
• Title of publication: 2'-Methoxy-5'-methoxycarbonylspiro[acridine-9(10<i>H</i>),4'(5'<i>H</i>)-thiazole]
• Authors of publication: Černák, J.; Kristian, P.; Bernát, J.; Lipkowski, J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 11
• Pages of publication: 2397 - 2399
• a: 7.764 ± 0.0008 Å
• b: 13.784 ± 0.002 Å
• c: 15.692 ± 0.0015 Å
• α: 90°
• β: 103.77 ± 0.008°
• γ: 90°
• Cell volume: 1631.1 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0663
• Residual factor for significantly intense reflections: 0.0538
• Weighted residual factors for all reflections: 0.1628
• Weighted residual factors for significantly intense reflections: 0.1445
• Goodness-of-fit parameter for all reflections: 1.07
• Goodness-of-fit parameter for significantly intense reflections: 1.104
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No