Information card for entry 4328805

Structure parameters

• Formula: C58 H40 Cl6 N4 O2 Sn
• Calculated formula: C58 H40 Cl6 N4 O2 Sn
• SMILES: C(Cl)(Cl)Cl.[Sn]123([n]4c5C(=c6n2c(=C(c2[n]1c(=C(c1n3c(C(=c4cc5)c3ccccc3)cc1)c1ccccc1)cc2)c1ccccc1)cc6)c1ccccc1)(Oc1ccccc1)Oc1ccccc1.C(Cl)(Cl)Cl
• Title of publication: Electron vs Energy Transfer in Arrays Featuring Two Bodipy Chromophores Axially Bound to a Sn(IV) Porphyrin via a Phenolate or Benzoate Bridge
• Authors of publication: Theodore Lazarides; Susanne Kuhri; Georgios Charalambidis; Manas K. Panda; Dirk M. Guldi; Athanassios G. Coutsolelos
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 4193 - 4204
• a: 11.081 ± 0.002 Å
• b: 11.231 ± 0.002 Å
• c: 11.729 ± 0.002 Å
• α: 96.28 ± 0.03°
• β: 114.24 ± 0.03°
• γ: 100.89 ± 0.03°
• Cell volume: 1278.2 ± 0.6 ų
• Cell temperature: 250 ± 2 K
• Ambient diffraction temperature: 250 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0772
• Residual factor for significantly intense reflections: 0.0529
• Weighted residual factors for significantly intense reflections: 0.1123
• Weighted residual factors for all reflections included in the refinement: 0.1228
• Goodness-of-fit parameter for all reflections included in the refinement: 0.995
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No