Information card for entry 2004648

Structure parameters

• Common name: Bromo-bis(triphenylphosphine-P})-(N,N-dibutyl-N'-phenylthiourea-S) copper(I)
• Chemical name: Bromobis(triphenylphosphine-P})-(N,N-dibutyl-N'-phenylthiourea-S) copper(I)
• Formula: C51 H54 Br Cu N2 P2 S
• Calculated formula: C51 H54 Br Cu N2 P2 S
• Title of publication: Bromo(<i>N</i>,<i>N</i>-dibutyl-<i>N</i>'-phenylthiourea-<i>S</i>)bis(triphenylphosphine-<i>P</i>)copper(I), [Cu(PPh~3~)~2~(dbptH)Br]
• Authors of publication: Singh, R.; Dikshit, S. K.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 3
• Pages of publication: 635 - 637
• a: 13.226 ± 0.002 Å
• b: 13.23 ± 0.002 Å
• c: 14.908 ± 0.003 Å
• α: 87.63 ± 0.01°
• β: 78.64 ± 0.02°
• γ: 66.76 ± 0.01°
• Cell volume: 2348.1 ± 0.7 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.072
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for all reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.032
• Goodness-of-fit parameter for all reflections: 1.854
• Goodness-of-fit parameter for significantly intense reflections: 2.225
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No