Information card for entry 7008099

Structure parameters

• Common name: s-(Co(tren-engly)) ZnCl4
• Formula: C10 H24 Cl4 Co N5 O2 Zn
• Calculated formula: C10 H24 Cl4 Co N5 O2 Zn
• SMILES: [Co]12345OC(=O)C[NH]1CC[NH]2CC[N]3(CC[NH2]4)CC[NH2]5.[Zn](Cl)(Cl)([Cl-])[Cl-]
• Title of publication: Facile cobalt(III) template synthesis of novel branched hexadentate polyamine monocarboxylates.
• Authors of publication: Barfod, Rasmus; Eriksen, Jette; Golding, Bernard T.; Hammershøi, Anders; Jacobsen, Thomas Amos; Langkilde, Annette; Larsen, Sine; Mønsted, Ole; Sargeson, Alan M.; Sørensen, Henning Osholm
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 3
• Pages of publication: 491 - 500
• a: 19.405 ± 0.001 Å
• b: 8.497 ± 0.0005 Å
• c: 23.116 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3811.5 ± 0.4 ų
• Cell temperature: 122.4 ± 0.5 K
• Number of distinct elements: 7
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0333
• Residual factor for significantly intense reflections: 0.0269
• Weighted residual factors for significantly intense reflections: 0.0538
• Weighted residual factors for all reflections included in the refinement: 0.0599
• Goodness-of-fit parameter for all reflections included in the refinement: 1.289
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No