Information card for entry 7002245

Structure parameters

• Formula: C49 H73.06 Cl4 N36 O19.53 Pt2
• Calculated formula: C49 H62 Cl4 N36 O19.534 Pt2
• Title of publication: A chemical preformulation study of a host‒guest complex of cucurbit[7]uril and a multinuclear platinum agent for enhanced anticancer drug delivery
• Authors of publication: Kennedy, Alan R.; Florence, Alastair J.; McInnes, Fiona J.; Wheate, Nial J.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 37
• Pages of publication: 7695 - 7700
• a: 28.225 ± 0.008 Å
• b: 22.859 ± 0.007 Å
• c: 29.728 ± 0.009 Å
• α: 90°
• β: 98.209 ± 0.004°
• γ: 90°
• Cell volume: 18984 ± 10 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.085
• Residual factor for significantly intense reflections: 0.0651
• Weighted residual factors for significantly intense reflections: 0.1863
• Weighted residual factors for all reflections included in the refinement: 0.2001
• Goodness-of-fit parameter for all reflections included in the refinement: 1.108
• Diffraction radiation wavelength: 0.6946 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No