Information card for entry 2018480

Structure parameters

• Chemical name: <i>catena</i>-Poly[[[(oxamide dioxime-κ^2^<i>N</i>,<i>N</i>')copper(II)]-μ-<i>L</i>-tartrato- κ^4^<i>O</i>^1^,O^2^:<i>O</i>^3^,<i>O</i>^4^] tetrahydrate]
• Formula: C6 H18 Cu N4 O12
• Calculated formula: C6 H18 Cu N4 O12
• SMILES: [Cu]123([N](O)=C(C(=[N]3O)N)N)(OC(=O)[C@H]([OH]1)[C@H]1[OH][Cu]4([N](O)=C(C(=[N]4O)N)N)OC1=O)OC(=O)[C@H]([OH]2)[C@H](C(=O)[O-])O.O.O.O.O.O.O.O.O
• Title of publication: <i>catena</i>-Poly[[[(oxamide dioxime-κ^2^<i>N</i>,<i>N</i>')copper(II)]-μ-<small>L</small>-tartrato-κ^4^<i>O</i>^1^,O^2^:<i>O</i>^3^,<i>O</i>^4^] tetrahydrate]: a chiral nanochannel framework hosting solvent water molecules
• Authors of publication: Bélombé, Michel M.; Nenwa, Justin; Wankap Kouamo, Jean S. T.; Ponou, Siméon; Fischer, Andreas
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 5
• Pages of publication: m131 - m134
• a: 14.6316 ± 0.0009 Å
• b: 14.6316 ± 0.0009 Å
• c: 6.6239 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1418.07 ± 0.15 ų
• Cell temperature: 299 K
• Ambient diffraction temperature: 299 K
• Number of distinct elements: 5
• Space group number: 96
• Hermann-Mauguin space group symbol: P 43 21 2
• Hall space group symbol: P 4nw 2abw
• Residual factor for all reflections: 0.0339
• Residual factor for significantly intense reflections: 0.0236
• Weighted residual factors for significantly intense reflections: 0.0497
• Weighted residual factors for all reflections included in the refinement: 0.0525
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes