Information card for entry 2231882

Structure parameters

• Chemical name: <i>catena</i>-Poly[[(triphenylphosphane)copper(I)]-di-μ-iodido- [(triphenylphosphane)copper(I)]-μ-{1,2-bis[1-(pyridin- 4-yl)ethylidene]hydrazine}]
• Formula: C50 H44 Cu2 I2 N4 P2
• Calculated formula: C50 H44 Cu2 I2 N4 P2
• SMILES: [I]1[Cu]([P](c2ccccc2)(c2ccccc2)c2ccccc2)([I][Cu]1([P](c1ccccc1)(c1ccccc1)c1ccccc1)[n]1ccc(cc1)C(C)=NN=C(C)c1cc[n](cc1)[Cu]1([P](c2ccccc2)(c2ccccc2)c2ccccc2)[I][Cu]([I]1)[P](c1ccccc1)(c1ccccc1)c1ccccc1)[n]1ccc(cc1)C(=NN=C(c1ccncc1)C)C
• Title of publication: <i>catena</i>-Poly[[(triphenylphosphane)copper(I)]-di-μ-iodido-[(triphenylphosphane)copper(I)]-μ-{1,2-bis[1-(pyridin-4-yl)ethylidene]hydrazine}]
• Authors of publication: Fun, Hoong-Kun; Loh, Wan-Sin; Patra, Goutam K.; Mukherjee, Anindita; Pal, Pankaj K.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 10
• Pages of publication: m1389
• a: 9.2788 ± 0.0004 Å
• b: 11.4322 ± 0.0005 Å
• c: 12.4204 ± 0.0005 Å
• α: 74.566 ± 0.002°
• β: 76.69 ± 0.002°
• γ: 72.067 ± 0.002°
• Cell volume: 1192.41 ± 0.09 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 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: 0.0378
• Residual factor for significantly intense reflections: 0.0324
• Weighted residual factors for significantly intense reflections: 0.0824
• Weighted residual factors for all reflections included in the refinement: 0.0863
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes