Experimental and computational investigations of new indole derivatives: a combined spectroscopic, SC-XRD, DFT/TD-DFT and QTAIM analysis (2020)
- Authors:
- USP affiliated authors: BRAGA, ATAUALPA ALBERT CARMO - IQ ; MORAIS, SARA FIGUEIRÊDO DE ALCÂNTARA - IQ
- Unidade: IQ
- DOI: 10.1016/j.molstruc.2020.127803
- Subjects: ANÁLISE ESPECTROSCÓPICA; ALCALOIDES
- Agências de fomento:
- Language: Inglês
- Imprenta:
- Source:
- Título: Journal of Molecular Structure
- ISSN: 0022-2860
- Volume/Número/Paginação/Ano: v. 1207, p. 1-16 art. 127803, 2020
- Status:
- Artigo possui versão em acesso aberto em repositório (Green Open Access)
- Versão do Documento:
- Versão submetida (Pré-print)
- Acessar versão aberta:
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ABNT
TARIQ, Sobia et al. Experimental and computational investigations of new indole derivatives: a combined spectroscopic, SC-XRD, DFT/TD-DFT and QTAIM analysis. Journal of Molecular Structure, v. 1207, p. 1-16 art. 127803, 2020Tradução . . Disponível em: https://doi.org/10.1016/j.molstruc.2020.127803. Acesso em: 02 abr. 2026. -
APA
Tariq, S., Khalid, M., Raza, A. R., Rubab, S. L., Morais, S. F. de A., Khan, M. U., et al. (2020). Experimental and computational investigations of new indole derivatives: a combined spectroscopic, SC-XRD, DFT/TD-DFT and QTAIM analysis. Journal of Molecular Structure, 1207, 1-16 art. 127803. doi:10.1016/j.molstruc.2020.127803 -
NLM
Tariq S, Khalid M, Raza AR, Rubab SL, Morais SF de A, Khan MU, Tahir MN, Braga AAC. Experimental and computational investigations of new indole derivatives: a combined spectroscopic, SC-XRD, DFT/TD-DFT and QTAIM analysis [Internet]. Journal of Molecular Structure. 2020 ; 1207 1-16 art. 127803.[citado 2026 abr. 02 ] Available from: https://doi.org/10.1016/j.molstruc.2020.127803 -
Vancouver
Tariq S, Khalid M, Raza AR, Rubab SL, Morais SF de A, Khan MU, Tahir MN, Braga AAC. Experimental and computational investigations of new indole derivatives: a combined spectroscopic, SC-XRD, DFT/TD-DFT and QTAIM analysis [Internet]. Journal of Molecular Structure. 2020 ; 1207 1-16 art. 127803.[citado 2026 abr. 02 ] Available from: https://doi.org/10.1016/j.molstruc.2020.127803 - Enriching NLO efficacy via designing non-fullerene molecules with the modification of acceptor moieties into ICIF2F: an emerging theoretical approach
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