Information card for entry 7036883

Structure parameters

• Chemical name: 2,6-{Ph2PNMe}2(NC5H3)]CuOTf
• Formula: C32 H29 Cu F3 N3 O3 P2 S
• Calculated formula: C32 H29 Cu F3 N3 O3 P2 S
• Title of publication: Coinage metal complexes supported by a "PN(3)P" scaffold.
• Authors of publication: Rao, Gyandshwar Kumar; Gorelsky, Serge I.; Korobkov, Ilia; Richeson, Darrin
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 44
• Pages of publication: 19153 - 19162
• a: 9.5696 ± 0.0002 Å
• b: 13.5271 ± 0.0003 Å
• c: 14.0741 ± 0.0003 Å
• α: 110.729 ± 0.001°
• β: 105.716 ± 0.001°
• γ: 95.9328 ± 0.001°
• Cell volume: 1599.57 ± 0.06 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0335
• Residual factor for significantly intense reflections: 0.0296
• Weighted residual factors for significantly intense reflections: 0.0803
• Weighted residual factors for all reflections included in the refinement: 0.0833
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No