Information card for entry 4323967

Structure parameters

• Formula: C16 H14 Ag N3 O6
• Calculated formula: C16 H14 Ag N3 O6
• Title of publication: Self-Assembly and X-ray Structure of a Dimetalloparacyclophane Incorporating a π-π Stacked Subunit
• Authors of publication: Chris M. Hartshorn; Peter J. Steel
• Journal of publication: Inorganic Chemistry
• Year of publication: 1996
• Journal volume: 35
• Pages of publication: 6902 - 6903
• a: 11.111 ± 0.001 Å
• b: 10.964 ± 0.001 Å
• c: 13.128 ± 0.001 Å
• α: 90°
• β: 92.324 ± 0.006°
• γ: 90°
• Cell volume: 1598 ± 0.2 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 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: 0.0323
• Residual factor for significantly intense reflections: 0.0257
• Weighted residual factors for all reflections: 0.0632
• Weighted residual factors for significantly intense reflections: 0.0619
• Goodness-of-fit parameter for all reflections: 0.94
• Goodness-of-fit parameter for significantly intense reflections: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKa
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No