Information card for entry 7027743

Structure parameters

• Chemical name: Bis(triphenylphosphine)tris(mu-pyridazine)dicopper(I) hexafluorophosphate dichloromethane adduct (1/1)
• Formula: C49 H44 Cl2 Cu2 F12 N6 P4
• Calculated formula: C49 H44 Cl2 Cu2 F12 N6 P4
• Title of publication: The role of hydrogen-bonding interactions in stabilising trigonal planar copper(I) in Cu(BF4)‒pyridazine‒nitrile systems †
• Authors of publication: Batsanov, Andrei S.; Begley, Michael J.; George, Michael W.; Hubberstey, Peter; Munakata, Meguma; Russell, Claire E.; Walton, Paul H.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 23
• Pages of publication: 4251
• a: 29.281 ± 0.009 Å
• b: 8.567 ± 0.003 Å
• c: 21.389 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5365 ± 3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• Space group number: 62
• Hermann-Mauguin space group symbol: P n a m
• Hall space group symbol: -P 2c 2n
• Residual factor for significantly intense reflections: 0.063
• Weighted residual factors for significantly intense reflections: 0.09
• Goodness-of-fit parameter for significantly intense reflections: 1.0223
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No