Information card for entry 7002973

Structure parameters

• Formula: C88 H82 Cu2 I2 N16 O P8
• Calculated formula: C88 H80 Cu2 I2 N16 O P8
• Title of publication: 1 : 2 Adducts of copper(i) halides with 1,2-bis(di-2-pyridylphosphino)ethane: solid state and solution structural studies and antitumour activity
• Authors of publication: Bowen, Richard J.; Navarro, Maribel; Shearwood, Anne-Marie J.; Healy, Peter C.; Skelton, Brian W.; Filipovska, Aleksandra; Berners-Price, Susan J.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 48
• Pages of publication: 10861 - 10870
• a: 12.6523 ± 0.0008 Å
• b: 12.6343 ± 0.0012 Å
• c: 14.9936 ± 0.001 Å
• α: 83.64 ± 0.007°
• β: 68.207 ± 0.006°
• γ: 86.633 ± 0.007°
• Cell volume: 2211.4 ± 0.3 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 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: 0.1291
• Residual factor for significantly intense reflections: 0.1064
• Weighted residual factors for significantly intense reflections: 0.2757
• Weighted residual factors for all reflections included in the refinement: 0.2955
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No