Information card for entry 2211728

Structure parameters

• Chemical name: (μ-4,4'-Bipyridine-κ^2^N:N')bis[(1,10-phenanthroline- κ^2^N,N')(triphenylphosphine-κP)copper(I)] bis(tetrafluoroborate)
• Formula: C70 H54 B2 Cu2 F8 N6 P2
• Calculated formula: C70 H54 B2 Cu2 F8 N6 P2
• SMILES: [B](F)(F)(F)[F-].c1[n]2c3c4[n]([Cu]2([n]2ccc(cc2)c2cc[n](cc2)[Cu]2([n]5cccc6ccc7ccc[n]2c7c56)[P](c2ccccc2)(c2ccccc2)c2ccccc2)[P](c2ccccc2)(c2ccccc2)c2ccccc2)cccc4ccc3cc1.[B](F)(F)(F)[F-]
• Title of publication: (μ-4,4'-Bipyridine-κ^2^<i>N</i>:<i>N</i>')bis[(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(triphenylphosphine-κ<i>P</i>)copper(I)] bis(tetrafluoroborate)
• Authors of publication: Chen, Jian-Hua; Song, Li-Qiang; Wang, De-Hui; Zhang, Jun-Feng; Fu, Wen-Fu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 1
• Pages of publication: m34 - m35
• a: 14.192 ± 0.007 Å
• b: 15.372 ± 0.007 Å
• c: 14.515 ± 0.006 Å
• α: 90°
• β: 92.495 ± 0.009°
• γ: 90°
• Cell volume: 3164 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 292 ± 2 K
• Number of distinct elements: 7
• 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: 0.1278
• Residual factor for significantly intense reflections: 0.0582
• Weighted residual factors for significantly intense reflections: 0.1288
• Weighted residual factors for all reflections included in the refinement: 0.1628
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes