Information card for entry 7001716

Structure parameters

• Formula: C30 H44 K2 N2 O
• Calculated formula: C30 H44 K2 N2 O
• SMILES: [N-](/C=C\[N-]c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C.[K+].O1CCCC1.[K+]
• Title of publication: Zinc compounds with or without Zn‒Zn bond: Alkali metal reduction of LZnCl2 (L = α-diimine ligands)
• Authors of publication: Yang, Peiju; Yang, Xiao-Juan; Yu, Jie; Liu, Yanyan; Zhang, Chunxi; Deng, Yu-Heng; Wu, Biao
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 29
• Pages of publication: 5773
• a: 13.166 ± 0.004 Å
• b: 17.945 ± 0.005 Å
• c: 13.192 ± 0.004 Å
• α: 90°
• β: 101.645 ± 0.006°
• γ: 90°
• Cell volume: 3052.6 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.114
• Residual factor for significantly intense reflections: 0.0584
• Weighted residual factors for significantly intense reflections: 0.147
• Weighted residual factors for all reflections included in the refinement: 0.1629
• Goodness-of-fit parameter for all reflections included in the refinement: 0.887
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No