Information card for entry 1519258

Structure parameters

• Formula: C30 H24 N4 P2 Pt S2
• Calculated formula: C30 H24 N4 P2 Pt S2
• SMILES: C12N(C=CS2)[Pt]2(N3C=CSC3=N[P]2(c2ccccc2)c2ccccc2)[P](c2ccccc2)(c2ccccc2)N=1
• Title of publication: C30H24N4P2PtS2
• Authors of publication: Smith, Martin B.; Light, Mark E.; Hursthouse, Michael B.
• Journal of publication: Crystal Structure Report Archive
• Year of publication: 2000
• Pages of publication: 735
• a: 14.9089 ± 0.0003 Å
• b: 11.4831 ± 0.0002 Å
• c: 16.9207 ± 0.0003 Å
• α: 90°
• β: 100.345 ± 0.001°
• γ: 90°
• Cell volume: 2849.74 ± 0.09 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0387
• Residual factor for significantly intense reflections: 0.0311
• Weighted residual factors for significantly intense reflections: 0.0753
• Weighted residual factors for all reflections included in the refinement: 0.0791
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No