Information card for entry 7006460

Structure parameters

• Formula: C119 H114 Cl10 F12 N12 O16 P4 Pt2 S4
• Calculated formula: C119 H106 Cl10 F12 N12 O16 P4 Pt2 S4
• Title of publication: New discrete metallocycles incorporating palladium(II) and platinum(II) corners and dipyridyldibenzotetraaza[14]annulene side units.
• Authors of publication: Beves, Jonathon E.; Chapman, Bodgan E.; Kuchel, Philip W.; Lindoy, Leonard F.; McMurtrie, John; McPartlin, Mary; Thordarson, Pall; Wei, Gang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 5
• Pages of publication: 744 - 750
• a: 16.0311 ± 0.001 Å
• b: 21.1386 ± 0.0014 Å
• c: 22.8833 ± 0.0015 Å
• α: 112.085 ± 0.001°
• β: 104.335 ± 0.001°
• γ: 92.307 ± 0.001°
• Cell volume: 6884.7 ± 0.8 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0859
• Residual factor for significantly intense reflections: 0.0521
• Weighted residual factors for significantly intense reflections: 0.1433
• Weighted residual factors for all reflections included in the refinement: 0.1606
• 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: Yes
• Has Fobs: No