Information card for entry 7048945

Structure parameters

• Formula: C21 H18 N3 O Pt Tl
• Calculated formula: C21 H18 N3 O Pt Tl
• Title of publication: New Pt→M (M = Ag or Tl) complexes based on anionic cyclometalated Pt(ii) complexes.
• Authors of publication: Campillo, David; Belío, Úrsula; Martín, Antonio
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 10
• Pages of publication: 3270 - 3283
• a: 5.94053 ± 0.00007 Å
• b: 15.5744 ± 0.0003 Å
• c: 22.0135 ± 0.0004 Å
• α: 70.3429 ± 0.0018°
• β: 88.3015 ± 0.0012°
• γ: 79.2532 ± 0.0013°
• Cell volume: 1883.15 ± 0.06 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.039
• Residual factor for significantly intense reflections: 0.0279
• Weighted residual factors for significantly intense reflections: 0.0561
• Weighted residual factors for all reflections included in the refinement: 0.0596
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No