Information card for entry 4318809

Structure parameters

• Formula: C88 H112 Li2 N4 O12 P4 Pt
• Calculated formula: C88 H112 Li2 N4 O12 P4 Pt
• SMILES: [Pt]12(P(C(=C(P1c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1)P(C(=C(P2c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1.[O]12CC[N]34CC[O]5CCOCCN6CC[O](CC1)[Li]1245[O](CC3)CC[O]1CC6.[O]12CC[N]34CC[O]5CCOCCN6CC[O](CC1)[Li]1245[O](CC3)CC[O]1CC6
• Title of publication: Dianionic Platinadiphospholene Complexes
• Authors of publication: Cornelia Tirla; Nicolas Mézailles; Louis Ricard; François Mathey; Pascal Le Floch
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 6032 - 6037
• a: 12.6947 ± 0.0002 Å
• b: 17.2161 ± 0.0003 Å
• c: 37.8877 ± 0.0005 Å
• α: 90 ± 0.0001°
• β: 90 ± 0.0001°
• γ: 90 ± 0.0001°
• Cell volume: 8280.5 ± 0.2 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.055
• Residual factor for significantly intense reflections: 0.0431
• Weighted residual factors for significantly intense reflections: 0.0829
• Weighted residual factors for all reflections included in the refinement: 0.0866
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No