Information card for entry 4075017

Structure parameters

• Common name: complex 3b
• Formula: C88 H92 Cd F20 N2 Pt2
• Calculated formula: C88 H92 Cd F20 N2 Pt2
• SMILES: [Pt]1([C]2#[C](c3ccccc3)[Cd]34562([C](#[C]3c2ccccc2)[Pt]([C]4#[C]5c2ccccc2)(c2c(c(c(c(c2F)F)F)F)F)c2c(c(c(c(c2F)F)F)F)F)[C]1#[C]6c1ccccc1)(c1c(c(c(c(c1F)F)F)F)F)c1c(c(c(c(c1F)F)F)F)F.C(CCC)[N+](CCCC)(CCCC)CCCC.C(CCC)[N+](CCCC)(CCCC)CCCC
• 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: 31.825 ± 0.0003 Å
• b: 17.073 ± 0.0002 Å
• c: 19.204 ± 0.0002 Å
• α: 90°
• β: 126.604 ± 0.001°
• γ: 90°
• Cell volume: 8376.53 ± 0.19 ų
• Cell temperature: 173 ± 1 K
• Ambient diffraction temperature: 173 ± 1 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0744
• Residual factor for significantly intense reflections: 0.0589
• Weighted residual factors for significantly intense reflections: 0.1367
• Weighted residual factors for all reflections included in the refinement: 0.1437
• Goodness-of-fit parameter for all reflections included in the refinement: 1.162
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No