Information card for entry 7038524

Structure parameters

• Chemical name: [Pt2Au2(bpy)2(Me2pz)4](PF6)2
• Formula: C44 H50 Au2 F12 N14 P2 Pt2
• Calculated formula: C44 H50 Au2 F12 N14 P2 Pt2
• SMILES: C(#N)C.[P](F)(F)(F)(F)(F)[F-].[Au]([n]1c(cc(C)n1[Pt]1([n]2c(c3cccc[n]13)cccc2)n1c(cc(C)[n]21)C)C)[n]1c(cc(C)n1[Pt]1([n]3c(c4cccc[n]14)cccc3)n1c(cc(C)[n]1[Au]2)C)C.C(#N)C.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Different structural preference of Ag(i) and Au(i) in neutral and cationic luminescent heteropolynuclear platinum(ii) complexes: Z (U)-shaped Pt2M2 type vs. trinuclear PtM2 type.
• Authors of publication: Nishihara, Kazuki; Ueda, Misa; Higashitani, Ami; Nakao, Yoshihide; Arikawa, Yasuhiro; Horiuchi, Shinnosuke; Sakuda, Eri; Umakoshi, Keisuke
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 12
• Pages of publication: 4978 - 4982
• a: 10.2943 ± 0.0013 Å
• b: 11.4915 ± 0.0015 Å
• c: 12.268 ± 0.002 Å
• α: 86.513 ± 0.005°
• β: 88.377 ± 0.005°
• γ: 65.233 ± 0.004°
• Cell volume: 1315.3 ± 0.3 ų
• Cell temperature: 93 K
• Ambient diffraction temperature: 93 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: 0.0252
• Residual factor for significantly intense reflections: 0.0183
• Weighted residual factors for significantly intense reflections: 0.0372
• Weighted residual factors for all reflections included in the refinement: 0.0381
• Goodness-of-fit parameter for all reflections included in the refinement: 0.933
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No