Information card for entry 7020255

Structure parameters

• Formula: C192 H216 F72 N28 O36 P12 Pd4
• Calculated formula: C192 H216 F72 N28 O36 P12 Pd4
• 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: 30.8974 ± 0.0009 Å
• b: 21.7294 ± 0.0006 Å
• c: 20.8416 ± 0.0006 Å
• α: 90 ± 0°
• β: 118.402 ± 0.0015°
• γ: 90 ± 0°
• Cell volume: 12308.4 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.1244
• Residual factor for significantly intense reflections: 0.0909
• Weighted residual factors for significantly intense reflections: 0.2375
• Weighted residual factors for all reflections included in the refinement: 0.2778
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No