Information card for entry 7009185

Structure parameters

• Formula: C26 H29 N3 O
• Calculated formula: C26 H29 N3 O
• SMILES: O(c1nc(ccc1)c1nc(ccc1)c1nc(ccc1)C)[C@@H]1C[C@@H]2CC[C@@]1(C)C2(C)C
• Title of publication: Regio- and diastereo-selective formation of dicopper(I) and disilver(I) double helicates with chiral 6-substituted 2,2'∶6',2″-terpyridines
• Authors of publication: Baum, Gerhard; Constable, Edwin C.; Fenske, Dieter; Housecroft, Catherine E.; Kulke, Torsten; Neuburger, Markus; Zehnder, Margareta
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 6
• Pages of publication: 945
• a: 6.929 ± 0.002 Å
• b: 10.696 ± 0.001 Å
• c: 29.978 ± 0.004 Å
• α: 90°
• β: 92.81 ± 0.01°
• γ: 90°
• Cell volume: 2219.1 ± 0.7 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for significantly intense reflections: 0.0469
• Weighted residual factors for significantly intense reflections: 0.0552
• Goodness-of-fit parameter for significantly intense reflections: 0.8702
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No