Information card for entry 7201876

Structure parameters

• Common name: (Pt(4'-(o-Cl-Ph)terpy)CN)SbF6
• Formula: C22 H14 Cl F6 N4 Pt Sb
• Calculated formula: C22 H14 Cl F6 N4 Pt Sb
• SMILES: [Pt]12([n]3ccccc3c3cc(cc([n]13)c1[n]2cccc1)c1ccccc1Cl)C#N.[Sb](F)(F)(F)(F)(F)[F-]
• Title of publication: Crystal structures and photoluminescent properties of the orange and yellow forms of [Pt{4′-(o-ClC6H4)trpy}(CN)]SbF6: an example of concomitant polymorphism
• Authors of publication: Field, John S.; Ledwaba, Lesibana P.; Munro, Orde Q.; McMillin, David R.
• Journal of publication: CrystEngComm
• Year of publication: 2008
• Journal volume: 10
• Journal issue: 6
• Pages of publication: 740
• a: 7.35 ± 0.004 Å
• b: 20.328 ± 0.006 Å
• c: 15.512 ± 0.005 Å
• α: 90°
• β: 102.55 ± 0.03°
• γ: 90°
• Cell volume: 2262.3 ± 1.6 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0426
• Residual factor for significantly intense reflections: 0.0384
• Weighted residual factors for significantly intense reflections: 0.1279
• Weighted residual factors for all reflections included in the refinement: 0.1322
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No