Information card for entry 1520087

Structure parameters

• Formula: C52 H72 Co2 Dy2 N10 O28
• Calculated formula: C52 H72 Co2 Dy2 N10 O28
• SMILES: [Dy]12345([OH]6[Dy]789%10([OH]4[Co]4%11%12([O]%132[Co]26([O]=C6C([N]2=Cc2cccc([O]1C)c%132)=C(N(N6c1ccccc1)C)C)([O]=C(O3)C(C)(C)C)[O]84c1c([O]7C)cccc1C=[N]%12C1C(=[O]%11)N(N(C=1C)C)c1ccccc1)[O]=C(O9)C(C)(C)C)([OH2])([OH]CC)[O]=N(O%10)=O)([OH2])([OH]CC)[O]=N(O5)=O.O=N(=O)[O-].O=N(=O)[O-]
• Title of publication: A new family of high nuclearity Co(II)/Dy(III) coordination clusters possessing robust and unseen topologies.
• Authors of publication: Berkoff, Benjamin; Griffiths, Kieran; Abdul-Sada, Alaa; Tizzard, Graham J.; Coles, Simon J.; Escuer, Albert; Kostakis, George E.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 28
• Pages of publication: 12788 - 12795
• a: 24.6279 ± 0.0017 Å
• b: 12.2953 ± 0.0005 Å
• c: 26.851 ± 0.002 Å
• α: 90°
• β: 115.817 ± 0.009°
• γ: 90°
• Cell volume: 7319.2 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 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: 0.0739
• Residual factor for significantly intense reflections: 0.0505
• Weighted residual factors for significantly intense reflections: 0.1226
• Weighted residual factors for all reflections included in the refinement: 0.1348
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No