Information card for entry 7104482

Structure parameters

• Formula: C33 H35 N9 O10
• Calculated formula: C33 H35 N9 O10
• Title of publication: Formation of a nitrate zipped dimeric capsule and un-zipping by chloride doping.
• Authors of publication: Arunachalam, M; Ghosh, Pradyut
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 22
• Pages of publication: 3184 - 3186
• a: 12.0912 ± 0.0015 Å
• b: 15.0534 ± 0.0019 Å
• c: 19.735 ± 0.003 Å
• α: 90°
• β: 90.931 ± 0.002°
• γ: 90°
• Cell volume: 3591.6 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1016
• Residual factor for significantly intense reflections: 0.088
• Weighted residual factors for significantly intense reflections: 0.2537
• Weighted residual factors for all reflections included in the refinement: 0.2688
• 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: No
• Has Fobs: No