Information card for entry 4075015

Structure parameters

• Common name: Compound 2c.3Me2CO
• Formula: C77 H68 Cd Cl2 F10 O3 P2 Pt
• Calculated formula: C77 H68 Cd Cl2 F10 O3 P2 Pt
• SMILES: [C]12#[C](c3ccc(cc3)C)[Cd]341(Cl)([Pt]2(c1c(c(c(c(c1F)F)F)F)F)([C]3#[C]4c1ccc(cc1)C)c1c(c(c(c(c1F)F)F)F)F)Cl.O=C(C)C.O=C(C)C.[P+](C)(c1ccccc1)(c1ccccc1)c1ccccc1.O=C(C)C.[P+](C)(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Synthesis, Structures, and Luminescence Behavior of Mixed Metal Alkynyl Platinum−Cadmium Complexes§
• Authors of publication: Fernández, Julio; Forniés, Juan; Gil, Belén; Gómez, Julio; Lalinde, Elena; Moreno, M. Teresa
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 9
• Pages of publication: 2274
• a: 21.2846 ± 0.0003 Å
• b: 18.2625 ± 0.0003 Å
• c: 19.04 ± 0.0003 Å
• α: 90°
• β: 98.374 ± 0.001°
• γ: 90°
• Cell volume: 7322.1 ± 0.2 ų
• Cell temperature: 223 ± 1 K
• Ambient diffraction temperature: 223 ± 1 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0561
• Residual factor for significantly intense reflections: 0.0389
• Weighted residual factors for significantly intense reflections: 0.0827
• Weighted residual factors for all reflections included in the refinement: 0.09
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No