Information card for entry 7020254

Structure parameters

• Formula: C39 H44 F18 N7 O7 P3 Pd
• Calculated formula: C39 H44 F18 N7 O7 P3 Pd
• Title of publication: [2]Catenanes and inclusion complexes derived from self-assembled rectangular Pd(II) and Pt(II) metallocycles.
• Authors of publication: Alvariño, Cristina; Terenzi, Alessio; Blanco, Víctor; García, Marcos D; Peinador, Carlos; Quintela, José M
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 39
• Pages of publication: 11992 - 11998
• a: 12.1541 ± 0.0004 Å
• b: 14.5559 ± 0.0005 Å
• c: 17.055 ± 0.0005 Å
• α: 81.47 ± 0.002°
• β: 73.532 ± 0.002°
• γ: 66.056 ± 0.002°
• Cell volume: 2642.58 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0957
• Residual factor for significantly intense reflections: 0.0777
• Weighted residual factors for significantly intense reflections: 0.2267
• Weighted residual factors for all reflections included in the refinement: 0.2422
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No