Information card for entry 7107870

Structure parameters

• Common name: Compound X
• Formula: C44 H48 B2 N14 O3 Pb2 Pt
• Calculated formula: C44 H46 B2 N14 O3 Pb2 Pt
• Title of publication: Novel mixed anion [trans-Pt(C[triple bond, length as m-dash]CTol)2(CN)2]2- as a building block of new luminescent PtII-TlI and PtII-PbII coordination polymers
• Authors of publication: Jesus R. Berenguer; Julio Fernandez; Elena Lalinde; Sergio Sanchez
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 6384
• a: 7.7464 ± 0.0006 Å
• b: 11.2992 ± 0.0007 Å
• c: 15.3002 ± 0.0012 Å
• α: 71.013 ± 0.004°
• β: 89.708 ± 0.003°
• γ: 79.895 ± 0.004°
• Cell volume: 1244.75 ± 0.16 ų
• Cell temperature: 173 ± 1 K
• Ambient diffraction temperature: 173 ± 1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0575
• Residual factor for significantly intense reflections: 0.0392
• Weighted residual factors for significantly intense reflections: 0.0881
• Weighted residual factors for all reflections included in the refinement: 0.0959
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No