Information card for entry 4338558

Structure parameters

• Common name: gi67
• Formula: C53.25 H36.5 Cd F10 N4 O1.75 Pt
• Calculated formula: C51 H32 Cd F10 N4 O Pt
• SMILES: c1(c(c(c(c(c1F)F)F)F)F)[Pt]1(c2c(c(c(c(c2F)F)F)F)F)[C](#Cc2ccccc2)[Cd]23([C]1#Cc1ccccc1)([n]1ccccc1c1cccc[n]31)[n]1c(c3cccc[n]23)cccc1.CC(=O)C
• Title of publication: Self-Assembly of Luminescent Alkynyl-Based Platinum‒Cadmium Complexes Containing Auxiliary Diimine or Terpyridine Ligands
• Authors of publication: Berenguer, Jesús R; Gil, Belén; Fernández, Julio; Forniés, Juan; Lalinde, Elena
• Journal of publication: Inorganic chemistry
• Year of publication: 2009
• Journal volume: 48
• Journal issue: 12
• Pages of publication: 5250 - 5262
• a: 11.4895 ± 0.0002 Å
• b: 12.1929 ± 0.0003 Å
• c: 19.8162 ± 0.0005 Å
• α: 91.246 ± 0.001°
• β: 91.652 ± 0.001°
• γ: 116.06 ± 0.002°
• Cell volume: 2490.96 ± 0.11 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0611
• Residual factor for significantly intense reflections: 0.0416
• Weighted residual factors for significantly intense reflections: 0.0849
• Weighted residual factors for all reflections included in the refinement: 0.0897
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No