Information card for entry 7000901

Structure parameters

• Formula: C129 H184 F8 In3 N9 O3 Pt
• Calculated formula: C129 H184 F8 In3 N9 O3 Pt
• SMILES: C1(=[N](c2c(cccc2C(C)C)C(C)C)[In]2([F]c3c([Pt]42([In]2[N](=C(N(C5CCCCC5)C5CCCCC5)N2c2c(cccc2C(C)C)C(C)C)c2c(cccc2C(C)C)C(C)C)c2c([F][In]54[N](=C(N5c4c(cccc4C(C)C)C(C)C)N(C4CCCCC4)C4CCCCC4)c4c(cccc4C(C)C)C(C)C)c(F)c(OC)c(F)c2F)c(F)c(F)c(OC)c3F)N1c1c(cccc1C(C)C)C(C)C)N(C1CCCCC1)C1CCCCC1.O(CC)CC
• Title of publication: Complexes of four-membered group 13 metal(I) N-heterocyclic carbene analogues with platinum(II) fragments
• Authors of publication: Moxey, Graeme J.; Jones, Cameron; Stasch, Andreas; Junk, Peter C.; Deacon, Glen B.; Woodul, William D.; Drago, Penny R.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 14
• Pages of publication: 2630 - 2636
• a: 28.285 ± 0.005 Å
• b: 30.155 ± 0.005 Å
• c: 15.337 ± 0.005 Å
• α: 90 ± 0.005°
• β: 105.309 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 12617 ± 5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• 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: 0.0438
• Residual factor for significantly intense reflections: 0.0308
• Weighted residual factors for significantly intense reflections: 0.0572
• Weighted residual factors for all reflections included in the refinement: 0.0605
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No