Information card for entry 7720064

Structure parameters

• Formula: C32 H42 Cl2 N4 O14
• Calculated formula: C32 H42 Cl2 N4 O14
• Title of publication: Hydroxyquinoline-functionalised aza-crown macrocycles for lanthanide coordination.
• Authors of publication: Siakalli, Christina; Osborne, Bradley E.; Brown, Ryan K.; Rocco, Claudia; Weiss, Dominik; García-España, Enrique V; Grundler, Pascal V.; Moiseeva, Anzhelika N.; Talip, Zeynep; van der Meulen, Nicholas P.; Ma, Michelle T.; Long, Nicholas J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2026
• Journal volume: 55
• Journal issue: 8
• Pages of publication: 3413 - 3421
• a: 10.2238 ± 0.0004 Å
• b: 14.4135 ± 0.0006 Å
• c: 12.2816 ± 0.0005 Å
• α: 90°
• β: 101.31 ± 0.004°
• γ: 90°
• Cell volume: 1774.68 ± 0.13 ų
• Cell temperature: 173 ± 3 K
• Ambient diffraction temperature: 173 ± 3 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.069
• Residual factor for significantly intense reflections: 0.0488
• Weighted residual factors for significantly intense reflections: 0.1235
• Weighted residual factors for all reflections included in the refinement: 0.1413
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No