Information card for entry 7151396

Structure parameters

• Formula: C22 H54.123 Cl9.877 N6 O3.123 Pt Zn3
• Calculated formula: C22 H48 Cl9.877 N6 O3.123 Pt Zn3
• Title of publication: Specificity in template syntheses of hexaaza-macrobicyclic cages: [Pt(Me5-tricosatrieneN6)]4+ and [Pt(Me5-tricosaneN6)]4+
• Authors of publication: Kylie N. Brown; Rodney J. Geue; Trevor W. Hambley; David C. R. Hockless; A. David Rae; Alan M. Sargeson
• Journal of publication: Org. Biomol. Chem.
• Year of publication: 2003
• Journal volume: 1
• Journal issue: 9
• Pages of publication: 1598 - 1608
• a: 23.502 ± 0.009 Å
• b: 15.453 ± 0.003 Å
• c: 13.68 ± 0.004 Å
• α: 90°
• β: 118.66 ± 0.02°
• γ: 90°
• Cell volume: 4360 ± 2 ų
• Cell temperature: 296.2 K
• Ambient diffraction temperature: 296.2 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: 0.038
• Residual factor for significantly intense reflections: 0.0277
• Weighted residual factors for all reflections: 0.0379
• Weighted residual factors for all reflections included in the refinement: 0.0364
• Goodness-of-fit parameter for all reflections: 1.619
• Goodness-of-fit parameter for all reflections included in the refinement: 1.704
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No