Information card for entry 7023747

Structure parameters

• Formula: C45 H47 Cu O6 P2
• Calculated formula: C45 H47 Cu O6 P2
• SMILES: C1(COCCOCCOCCOC)=[O][Cu](O1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Copper(ii) and triphenylphosphine copper(i) ethylene glycol carboxylates: synthesis, characterisation and copper nanoparticle generation.
• Authors of publication: Adner, David; Möckel, Stefan; Korb, Marcus; Buschbeck, Roy; Rüffer, Tobias; Schulze, Steffen; Mertens, Lutz; Hietschold, Michael; Mehring, Michael; Lang, Heinrich
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 44
• Pages of publication: 15599 - 15609
• a: 15.9464 ± 0.0008 Å
• b: 10.6978 ± 0.0003 Å
• c: 23.2985 ± 0.0011 Å
• α: 90°
• β: 91.701 ± 0.004°
• γ: 90°
• Cell volume: 3972.8 ± 0.3 ų
• Cell temperature: 104 ± 1 K
• Ambient diffraction temperature: 104 ± 1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.049
• Residual factor for significantly intense reflections: 0.0354
• Weighted residual factors for significantly intense reflections: 0.0814
• Weighted residual factors for all reflections included in the refinement: 0.0863
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No