Information card for entry 7005521

Structure parameters

• Formula: C72 H56 P4 Pt2
• Calculated formula: C72 H56 P4 Pt2
• SMILES: [P]1([Pt]2([P](c3c(cccc3)[Pt]3([P](c4c3cccc4)(c3ccccc3)c3ccccc3)[P](c3c2cccc3)(c2ccccc2)c2ccccc2)(c2ccccc2)c2ccccc2)c2c1cccc2)(c1ccccc1)c1ccccc1
• Title of publication: ortho-Metallated complexes of platinum(II) and diplatinum(I) containing the carbanions (2-diphenylphosphino)phenyl and (2-diphenylphosphino)-n-tolyl (n = 5, 6).
• Authors of publication: Bennett, Martin A.; Bhargava, Suresh K.; Messelhäuser, Johannes; Privér, Steven H; Welling, Lee L.; Willis, Anthony C.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 29
• Pages of publication: 3158 - 3169
• a: 20.195 ± 0.0003 Å
• b: 23.2688 ± 0.0003 Å
• c: 24.9714 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 11734.4 ± 0.3 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 4
• Space group number: 73
• Hermann-Mauguin space group symbol: I b c a
• Hall space group symbol: -I 2b 2c
• Residual factor for all reflections: 0.0649
• Residual factor for significantly intense reflections: 0.0398
• Weighted residual factors for all reflections: 0.0619
• Weighted residual factors for all reflections included in the refinement: 0.0534
• Goodness-of-fit parameter for all reflections: 2.034
• Goodness-of-fit parameter for all reflections included in the refinement: 1.935
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No