Information card for entry 7015148

Structure parameters

• Formula: C16 H14 Au2 Cl6 N6
• Calculated formula: C16 H14 Au2 Cl6 N6
• SMILES: [Au]1(Cl)(Cl)[n]2c(n(cc2)C)c2c(c3[n]1ccn3C)nc1ccccc1n2.[Au](Cl)(Cl)(Cl)[Cl-]
• Title of publication: 2,3-Bis(1-methylimidazol-2-yl)quinoxaline (bmiq), a new ligand with decoupled electron transfer and metal coordination sites: the very different redox behaviour of isoelectronic complexes with [PtCl2] and [AuCl2]+.
• Authors of publication: Bulak, Ece; Varnali, Tereza; Schwederski, Brigitte; Sarkar, Biprajit; Hartenbach, Ingo; Fiedler, Jan; Kaim, Wolfgang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 12
• Pages of publication: 2757 - 2763
• a: 9.7732 ± 0.0002 Å
• b: 24.6103 ± 0.0005 Å
• c: 10.1615 ± 0.0002 Å
• α: 90°
• β: 107.095 ± 0.001°
• γ: 90°
• Cell volume: 2336.08 ± 0.08 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0473
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.068
• Weighted residual factors for all reflections included in the refinement: 0.0728
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No