Information card for entry 7035267

Structure parameters

• Formula: C31 H25 Cu I N2 O P
• Calculated formula: C31 H25 Cu I N2 O P
• SMILES: I[Cu]1([P](c2ccccc2)(c2ccccc2)CO)[n]2c3c(cccc3)ccc2c2[n]1c1c(cccc1)cc2
• Title of publication: Copper(i) complexes with phosphine derived from sparfloxacin. Part I - structures, spectroscopic properties and cytotoxicity.
• Authors of publication: Komarnicka, Urszula K.; Starosta, Radosław; Kyzioł, Agnieszka; Jeżowska-Bojczuk, Małgorzata
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 28
• Pages of publication: 12688 - 12699
• a: 10.234 ± 0.001 Å
• b: 10.495 ± 0.001 Å
• c: 14.945 ± 0.002 Å
• α: 103.77 ± 0.01°
• β: 91.56 ± 0.02°
• γ: 118.9 ± 0.02°
• Cell volume: 1345.7 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.1289
• Residual factor for significantly intense reflections: 0.0709
• Weighted residual factors for significantly intense reflections: 0.1154
• Weighted residual factors for all reflections included in the refinement: 0.1357
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No