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New Investigations of Geometric, Electronic, and Spectroscopic Properties of Tetrapyrrolic Macrocycles by a TD−DFT Approach. Carbon, Nitrogen, and Chalcogen (O, S, Se) Peripheral Substitution Effects on Ni(II) Porphyrazinato Complexes
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New Investigations of Geometric, Electronic, and Spectroscopic Properties of Tetrapyrrolic Macrocycles by a TD−DFT Approach. Carbon, Nitrogen, and Chalcogen (O, S, Se) Peripheral Substitution Effects on Ni(II) Porphyrazinato Complexes †

Infante, Ivan; Lelj, Francesco
  • 期刊名称Journal of Chemical Theory and Computation
  • 作者Infante, Ivan; Lelj, Francesco
  • 卷第3卷
  • 期第3期
  • 印刷ISSN1549-9618
  • 电子ISSN1549-9626
  • 文件大小398.73KB
  • 发表时间2007-05
  • DOI10.1021/ct6003609
  • 页码838-851
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