Information card for entry 7030466

Structure parameters

• Formula: C33 H32 N2 Pt Ru
• Calculated formula: C33 H32 N2 Pt Ru
• SMILES: [Pt]1([n]2ccc[c]34[Ru]56789%10%11([c]%12([c]8(C)[c]7(C)[c]6(C)[c]5%12C)C)[cH]3[c]39ccc[n]1[c]%103[c]24%11)(c1ccccc1)c1ccccc1
• Title of publication: Heterodinuclear complexes of 4,5-diazafluorene derivatives displaying η(5),κ(2)-[N,N] and η(5),κ(1)-N coordination modes.
• Authors of publication: Batcup, Rhys; Annibale, Vincent T.; Song, Datong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 23
• Pages of publication: 8951 - 8958
• a: 12.0472 ± 0.0007 Å
• b: 14.7379 ± 0.0011 Å
• c: 15.9362 ± 0.0011 Å
• α: 97.095 ± 0.003°
• β: 91.064 ± 0.003°
• γ: 101.555 ± 0.003°
• Cell volume: 2748.2 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0595
• Residual factor for significantly intense reflections: 0.0364
• Weighted residual factors for significantly intense reflections: 0.064
• Weighted residual factors for all reflections included in the refinement: 0.0708
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No