Information card for entry 7010434

Structure parameters

• Formula: C44 H56 Ag B F4 O11 P2
• Calculated formula: C44 H52 Ag0.5 B F4 O11 P2
• Title of publication: Calix[4]arene-derived diphosphines, diphosphinites and diphosphites as chelating ligands for transition metal ions. Encapsulation of silver(I) in a calix-crown diphosphite
• Authors of publication: Jeunesse, Catherine; Dieleman, Cedric; Steyer, Stéphane; Matt, Dominique
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2001
• Journal issue: 6
• Pages of publication: 881
• a: 11.9325 ± 0.0002 Å
• b: 17.6619 ± 0.0002 Å
• c: 21.2455 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4477.5 ± 0.11 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 7
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.066
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for all reflections: 0.101
• Weighted residual factors for all reflections included in the refinement: 0.062
• Goodness-of-fit parameter for all reflections: 1.757
• Goodness-of-fit parameter for all reflections included in the refinement: 1.158
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No