Information card for entry 2238774

Structure parameters

• Chemical name: Bis(μ-<i>L</i>-arginine-κ^3^<i>N</i>^2^,<i>O</i>:<i>O</i>')bis(<i>L</i>-arginine-κ^2^<i>N</i>^2^,<i>O</i>)tetra-μ-chlorido-tetrachloridotetracopper(II)
• Formula: C6 H14 Cl2 Cu N4 O2
• Calculated formula: C6 H14 Cl2 Cu N4 O2
• SMILES: C1(=O)[C@H](CCCNC(=[NH2+])N)[NH2][Cu](O1)(Cl)Cl
• Title of publication: Bis(μ-<small>L</small>-arginine-κ^3^<i>N</i>^2^,<i>O</i>:<i>O</i>')bis(<small>L</small>-arginine-κ^2^<i>N</i>^2^,<i>O</i>)tetra-μ-chlorido-tetrachloridotetracopper(II)
• Authors of publication: Arularasan, P.; B.Sivakumar; Chakkaravarthi, G.; Mohan, R.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 11
• Pages of publication: m583 - m584
• a: 11.9315 ± 0.0008 Å
• b: 12.8805 ± 0.001 Å
• c: 15.3949 ± 0.0013 Å
• α: 90°
• β: 99.271 ± 0.004°
• γ: 90°
• Cell volume: 2335 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0703
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.1013
• Weighted residual factors for all reflections included in the refinement: 0.1119
• Goodness-of-fit parameter for all reflections included in the refinement: 0.978
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No