Information card for entry 2010535

Structure parameters

• Formula: C26 H50 Cd Cl N5 O12
• Calculated formula: C26 H50 Cd Cl N5 O12
• 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) 4-nitrophenolate perchlorate hydrate
• Authors of publication: Davies, Philip. J.; Lincoln, Stephen F.; Smith, Christopher B.; Taylor, Max R.; Wainwright, Kevin P.; Wallwork, Kia S.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 1
• Pages of publication: 28 - 30
• a: 13.9929 ± 0.0011 Å
• b: 19.6661 ± 0.0011 Å
• c: 24.89 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6849.4 ± 1.1 ų
• Cell temperature: 200 ± 1 K
• Ambient diffraction temperature: 200 ± 1 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.073
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for all reflections: 0.077
• Weighted residual factors for all reflections included in the refinement: 0.07
• Goodness-of-fit parameter for all reflections: 1.471
• Goodness-of-fit parameter for significantly intense reflections: 1.403
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo_Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No