Information card for entry 7007968

Structure parameters

• Common name: 3
• Formula: C39 H31 B Cu N6 P
• Calculated formula: C39 H29.5 B Cu N6 P
• Title of publication: Cu(I) and Zn(II) complexes of 7-azaindole-containing scorpionates: structures, luminescence and fluxionality.
• Authors of publication: Song, Datong; Jia, Wen Li; Wu, Gang; Wang, Suning
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 3
• Pages of publication: 433 - 438
• a: 9.697 ± 0.003 Å
• b: 11.888 ± 0.004 Å
• c: 16.584 ± 0.005 Å
• α: 71.728 ± 0.005°
• β: 73.666 ± 0.005°
• γ: 79.474 ± 0.005°
• Cell volume: 1732.7 ± 1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0738
• Residual factor for significantly intense reflections: 0.0481
• Weighted residual factors for significantly intense reflections: 0.1177
• Weighted residual factors for all reflections included in the refinement: 0.1488
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No