Information card for entry 2003596

Structure parameters

• Formula: C30 H44 Cl2 N2 O13
• Calculated formula: C30 H44 Cl2 N2 O13
• Title of publication: The Water Inclusion Complex of a Fluorescent Diprotonated Anthracenocryptand
• Authors of publication: Lahrahar, N.; Marsau, P.; Bouas-Laurent, H.; Desvergne, J.-P.; Fages, F.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 6
• Pages of publication: 1218 - 1221
• a: 12.258 ± 0.007 Å
• b: 22.289 ± 0.004 Å
• c: 13.297 ± 0.006 Å
• α: 90°
• β: 104.64 ± 0.04°
• γ: 90°
• Cell volume: 3515 ± 3 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for significantly intense reflections: 0.061
• Weighted residual factors for significantly intense reflections: 0.056
• Goodness-of-fit parameter for significantly intense reflections: 1.47
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No