Information card for entry 7033381

Structure parameters

• Formula: C38 H46 Cu N2 O10 P2
• Calculated formula: C38 H46 Cu N2 O10 P2
• SMILES: [Cu]12(OP(=O)(O)c3ccccc3)(OP(=O)(O)c3ccccc3)([N](=C(c3ccccc3)C3([OH]1)CCCCC3)O)[N](=C(c1ccccc1)C1([OH]2)CCCCC1)O
• Title of publication: Structural variations in metal complexes of a tertiary α-hydroxyoxime.
• Authors of publication: D'Alessio, Daniel; Lombardo, Daniel M.; Vaughan, Jamila G.; Skelton, Brian W.; Barnard, Keith R.; Ogden, Mark I.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 16
• Pages of publication: 7163 - 7168
• a: 9.9432 ± 0.0003 Å
• b: 19.4692 ± 0.0006 Å
• c: 20.9054 ± 0.0005 Å
• α: 96.039 ± 0.002°
• β: 95.892 ± 0.002°
• γ: 99.024 ± 0.002°
• Cell volume: 3945.4 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.1052
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.0835
• Weighted residual factors for all reflections included in the refinement: 0.0925
• Goodness-of-fit parameter for all reflections included in the refinement: 0.812
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No