Information card for entry 7030465

Structure parameters

• Formula: C49 H57 K N2 O4 Pt
• Calculated formula: C49 H57 K N2 O4 Pt
• SMILES: [Pt]1([n]2c(ccc3c2c2[n]1c(ccc2[c-]3)c1c(cc(cc1C)C)C)c1c(cc(cc1C)C)C)(c1ccccc1)c1ccccc1.[K]12([O](C)CC[O]1C)[O](C)CC[O]2C
• 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: 12.0476 ± 0.0006 Å
• b: 15.8026 ± 0.0007 Å
• c: 12.8251 ± 0.0007 Å
• α: 90°
• β: 114.284 ± 0.002°
• γ: 90°
• Cell volume: 2225.64 ± 0.19 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0637
• Residual factor for significantly intense reflections: 0.0503
• Weighted residual factors for significantly intense reflections: 0.1132
• Weighted residual factors for all reflections included in the refinement: 0.1182
• Goodness-of-fit parameter for all reflections included in the refinement: 1.11
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No