Information card for entry 7039864

Structure parameters

• Formula: C13 H36 K N4 O14 P3
• Calculated formula: C13 H36 K N4 O14 P3
• Title of publication: Formation and decomplexation kinetics of copper(ii) complexes with cyclen derivatives having mixed carboxylate and phosphonate pendant arms.
• Authors of publication: Ševčík, R; Vaněk, J; Michalicová, R; Lubal, P.; Hermann, P.; Santos, I. C.; Santos, I.; Campello, M. P. C.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 32
• Pages of publication: 12723 - 12733
• a: 37.6442 ± 0.0006 Å
• b: 8.4336 ± 0.0001 Å
• c: 16.14 ± 0.0003 Å
• α: 90°
• β: 110.457 ± 0.001°
• γ: 90°
• Cell volume: 4800.91 ± 0.13 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0461
• Residual factor for significantly intense reflections: 0.0382
• Weighted residual factors for significantly intense reflections: 0.0993
• Weighted residual factors for all reflections included in the refinement: 0.1027
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No