Information card for entry 7105477

Structure parameters

• Formula: C23 H32 N Y
• Calculated formula: C23 H32 N Y
• SMILES: [Y]123456789([CH](=[CH2]1)C7)([N](c1c([c]72[c]3([c]4([c]5([c]67C)C)C)C)cccc1)(C)C)C[CH]8=[CH2]9
• Title of publication: Living catalyzed-chain-growth polymerization and block copolymerization of isoprene by rare-earth metal allyl precursors bearing a constrained-geometry-conformation ligand.
• Authors of publication: Jian, Zhongbao; Cui, Dongmei; Hou, Zhaomin; Li, Xiaofang
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 17
• Pages of publication: 3022 - 3024
• a: 8.7801 ± 0.0006 Å
• b: 18.6736 ± 0.0013 Å
• c: 12.9685 ± 0.0009 Å
• α: 90°
• β: 98.4 ± 0.001°
• γ: 90°
• Cell volume: 2103.5 ± 0.3 ų
• Cell temperature: 186.5 ± 0.2 K
• Ambient diffraction temperature: 186.5 ± 0.2 K
• Number of distinct elements: 4
• 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: 0.0422
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.0741
• Weighted residual factors for all reflections included in the refinement: 0.0798
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No