Information card for entry 4083515

Structure parameters

• Common name: sr180
• Formula: C42 H38 N2 Pt2
• Calculated formula: C42 H38 N2 Pt2
• SMILES: [Pt]123(c4ccccc4c4[n]1c1c(cc4)cccc1)[C](C(C)(C)C)#[C]2[Pt]12(c4ccccc4c4[n]1c1c(cc4)cccc1)[C]3#[C]2C(C)(C)C
• Title of publication: Synthesis, Structural, and Photophysical Studies of Phenylquinoline and Phenylquinolinyl Alkynyl Based Pt(II) Complexes
• Authors of publication: Lalinde, Elena; Moreno, M. Teresa; Ruiz, Santiago; Sánchez, Sergio
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 12
• Pages of publication: 3078
• a: 10.7312 ± 0.0006 Å
• b: 11.0656 ± 0.0006 Å
• c: 16.479 ± 0.0009 Å
• α: 82.168 ± 0.003°
• β: 74.397 ± 0.002°
• γ: 63.497 ± 0.002°
• Cell volume: 1686.36 ± 0.16 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0401
• Residual factor for significantly intense reflections: 0.0315
• Weighted residual factors for significantly intense reflections: 0.0744
• Weighted residual factors for all reflections included in the refinement: 0.0784
• Goodness-of-fit parameter for all reflections included in the refinement: 1.102
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No