Information card for entry 7011288

Structure parameters

• Formula: C12 H20 Ag B F4 N4 S
• Calculated formula: C12 H20 Ag B F4 N4 S
• Title of publication: Nitrile functionalised pendant-arm derivatives of aza- and mixed donor macrocyclic ligands as new building blocks for inorganic crystal engineering
• Authors of publication: Lorenzo Tei; Alexander J. Blake; Paul A. Cooke; Claudia Caltagirone; Francesco Demartin; Vito Lippolis; Francesca Morale; Claire Wilson; Martin Schröder
• Journal of publication: J. Chem. Soc., Dalton Trans.
• Year of publication: 2002
• Journal issue: 8
• Pages of publication: 1662 - 1670
• a: 7.6037 ± 0.0011 Å
• b: 13.542 ± 0.002 Å
• c: 15.674 ± 0.002 Å
• α: 90°
• β: 90.598 ± 0.013°
• γ: 90°
• Cell volume: 1613.9 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• 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: 0.0294
• Residual factor for significantly intense reflections: 0.0238
• Weighted residual factors for all reflections: 0.0551
• Weighted residual factors for significantly intense reflections: 0.049
• Goodness-of-fit parameter for all reflections: 1.154
• Goodness-of-fit parameter for significantly intense reflections: 1.137
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No