Information card for entry 7053816

Structure parameters

• Chemical name: 9-(4-methoxyphenyl)-9H-xanthen-9-ol 1-naphthylamine clathrate
• Formula: C25 H20 N0.5 O3
• Calculated formula: C25 H20 N0.5 O3
• Title of publication: Enclathration by a xanthenol host via solid‒solid reactions: structures and kinetics
• Authors of publication: Jacobs, Ayesha; Nassimbeni, Luigi R.; Nohako, Kanyisa L.; Ramon, Gaelle; Taljaard, Jana H.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2009
• Journal volume: 33
• Journal issue: 9
• Pages of publication: 1960
• a: 8.4231 ± 0.0017 Å
• b: 9.0634 ± 0.0018 Å
• c: 13.014 ± 0.003 Å
• α: 96.6 ± 0.03°
• β: 91.87 ± 0.03°
• γ: 109.87 ± 0.03°
• Cell volume: 925.4 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1471
• Residual factor for significantly intense reflections: 0.1109
• Weighted residual factors for significantly intense reflections: 0.3526
• Weighted residual factors for all reflections included in the refinement: 0.3939
• Goodness-of-fit parameter for all reflections included in the refinement: 1.583
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No