Information card for entry 4336866

Structure parameters

• Formula: C13 H18 N2 O4 Pt S4 Zn
• Calculated formula: C13 H18 N2 O4 Pt S4 Zn
• SMILES: [Pt]1234[Zn]([O]=C(S1)C)([O]=C(S2)C)([O]=C(S3)C)([O]=C(S4)C)[n]1ccc(N)cc1
• Title of publication: Pt...Pt vs Pt...S Contacts Between Pt-Containing Heterobimetallic Lantern Complexes
• Authors of publication: Frederick G. Baddour; Stephanie R. Fiedler; Matthew P. Shores; Jeffrey W. Bacon; James A. Golen; Arnold L. Rheingold; Linda H. Doerrer
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 13562 - 13575
• a: 8.9262 ± 0.0014 Å
• b: 10.6627 ± 0.0017 Å
• c: 11.0745 ± 0.0018 Å
• α: 81.62 ± 0.007°
• β: 76.126 ± 0.006°
• γ: 72.97 ± 0.007°
• Cell volume: 975.2 ± 0.3 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 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: 0.0221
• Residual factor for significantly intense reflections: 0.021
• Weighted residual factors for significantly intense reflections: 0.0525
• Weighted residual factors for all reflections included in the refinement: 0.0533
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No