Information card for entry 2015005

Structure parameters

• Common name: [Cu(dmp)2]2[PF6]2ACN0.5bpmh
• Chemical name: Bis[bis(2,9-dimethyl-1,10-phenanthroline-κ^2^N,N')copper(I)] bis(hexafluorophosphate) hemi[bis(4-pyridylmethylidyne)hydrazine] acetonitrile solvate
• Formula: C64 H56 Cu2 F12 N11 P2
• Calculated formula: C64 H56 Cu2 F12 N11 P2
• Title of publication: Two novel bis(2,9-dimethyl-1,10-phenanthroline)copper(I) complexes: [Cu(dmp)~2~]~2~(PF~6~)~2~·0.5(bpmh)·CH~3~CN and [Cu(dmp)~2~][N(CN)~2~]
• Authors of publication: Graham King; Milan Gembicky; Philip Coppens
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 7
• Pages of publication: m329 - m332
• a: 13.6775 ± 0.0005 Å
• b: 14.0221 ± 0.0005 Å
• c: 17.2879 ± 0.0006 Å
• α: 111.776 ± 0.001°
• β: 91.679 ± 0.001°
• γ: 104.212 ± 0.001°
• Cell volume: 2957.96 ± 0.18 ų
• Cell temperature: 90 ± 1 K
• Ambient diffraction temperature: 90 ± 1 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: 0.0357
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.0779
• Weighted residual factors for all reflections included in the refinement: 0.0821
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes