Information card for entry 2200845

Structure parameters

• Formula: C27 H50 Cd Cl N4 O11.5
• Calculated formula: C27 H50 Cd Cl N4 O11.5
• Title of publication: {Δ-1,4,7,10-Tetrakis[(<i>S</i>)-2-hydroxypropyl-κ<i>O</i>]-1,4,7,10-tetraazacyclododecane-κ^4^<i>N</i>}cadmium(II) salicylate perchlorate hemihydrate
• Authors of publication: Smith, Christopher. B.; Lincoln, Stephen. F.; Taylor, Max. R.; Wainwright, Kevin. P.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 1
• Pages of publication: m33 - m35
• a: 9.608 ± 0.002 Å
• b: 12.423 ± 0.003 Å
• c: 14.549 ± 0.004 Å
• α: 90°
• β: 107.47 ± 0.01°
• γ: 90°
• Cell volume: 1656.5 ± 0.7 ų
• Cell temperature: 168 ± 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 significantly intense reflections: 0.037
• Weighted residual factors for all reflections included in the refinement: 0.061
• Goodness-of-fit parameter for all reflections included in the refinement: 1.418
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes