Information card for entry 4064188

Structure parameters

• Common name: ad358-1
• Formula: C68.6 H60.6 Cl6.8 N4 O1.5 Pt4
• Calculated formula: C64 H50 Cl2 N4 Pt4
• SMILES: c1ccc2ccc3cccc4c3c2[n]1[Pt]124[C](#[C]1C(C)(C)C)[Pt]1(c3cccc4ccc5ccc[n]1c5c34)[Cl][Pt]1(c3cccc4ccc5ccc[n]1c5c34)[C]1#[C](C(C)(C)C)[Pt]31(c1cccc4ccc5ccc[n]3c5c14)[Cl]2
• Title of publication: Remarkable Influence of the Cyclometalating Ligand on the Nuclearity and Properties of Heterobridged (μ-X)(μ-C≡CR) Platinum(II) Complexes
• Authors of publication: Berenguer, Jesús R.; Díez, Álvaro; García, Ana; Lalinde, Elena; Moreno, M. Teresa; Sánchez, Sergio; Torroba, Javier
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 6
• Pages of publication: 1646
• a: 48.7851 ± 0.001 Å
• b: 17.6611 ± 0.0003 Å
• c: 36.0601 ± 0.0007 Å
• α: 90°
• β: 126.509 ± 0.001°
• γ: 90°
• Cell volume: 24972.4 ± 0.9 ų
• Cell temperature: 173 ± 1 K
• Ambient diffraction temperature: 173 ± 1 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.069
• Residual factor for significantly intense reflections: 0.0441
• Weighted residual factors for significantly intense reflections: 0.1022
• Weighted residual factors for all reflections included in the refinement: 0.1098
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No