Information card for entry 1540644

Structure parameters

• Formula: C16 H20 Dy N5 O11
• Calculated formula: C16 H20 Dy N5 O11
• SMILES: [Dy]1234(ON(=[O]4)=O)([OH]C)([O]=C(N[N]3=Cc3c(O2)c(ccc3)OC)c2ccncc2)([O]=N(O1)=O)[OH]C
• Title of publication: Dinuclear Lanthanide (III) Coordination Polymers in a Domino Reaction
• Authors of publication: Loukopoulos, Edward; Griffiths, Kieran; Akien, Geoffrey; Kourkoumelis, Nikolaos; Abdul-Sada, Alaa; Kostakis, George
• Journal of publication: Inorganics
• Year of publication: 2015
• Journal volume: 3
• Journal issue: 4
• Pages of publication: 448
• a: 10.3419 ± 0.0003 Å
• b: 14.585 ± 0.0005 Å
• c: 15.7309 ± 0.0005 Å
• α: 95.672 ± 0.003°
• β: 95.377 ± 0.002°
• γ: 109.768 ± 0.003°
• Cell volume: 2201.46 ± 0.13 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0372
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.0743
• Weighted residual factors for all reflections included in the refinement: 0.0793
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No