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Formation of 3-buten-1-ol over metal encapsulated ZSM-5 from formaldehyde and propene: A Density Functional Theory study

Yıl 2018, Cilt: 2 Sayı: 2, 28 - 35, 15.12.2018

Tamilmani Selvaraj Renganathan Rajalingam Viswanathan Balasubramanian

https://doi.org/10.33435/tcandtc.429557

Öz

Carbonyl-ene
reaction, which involves C-C bond formation, is an essential organic reaction. Here,
we explained the possibility of the C-C
bond formation between HCHO and propene catalyzed with Ni2+, Pd2+,
and Pt2+ exchanged on ZSM-5 zeolite (metal-ZSM-5) by density
functional theory. Pt-ZSM-5 exhibits a better activity than other metal-ZSM-5
reported in present work due to high charge transfer among the platinum and
formaldehyde. 

Anahtar Kelimeler

Carbonyl-ene reaction ZSM-5 zeolite Density Functional Theory Natural Bond Orbital

Kaynakça

  • [1] J.Angelo, G.Stork, J. Am. Chem. Soc. 96 (1974) 7114

Yıl 2018, Cilt: 2 Sayı: 2, 28 - 35, 15.12.2018

Tamilmani Selvaraj Renganathan Rajalingam Viswanathan Balasubramanian

https://doi.org/10.33435/tcandtc.429557

Öz

Kaynakça

  • [1] J.Angelo, G.Stork, J. Am. Chem. Soc. 96 (1974) 7114
Toplam 1 adet kaynakça vardır.

Ayrıntılar

Birincil Dil İngilizce
Bölüm Research Article
Yazarlar

Tamilmani Selvaraj

Renganathan Rajalingam Bu kişi benim

Viswanathan Balasubramanian

Yayımlanma Tarihi 15 Aralık 2018
Gönderilme Tarihi 1 Haziran 2018
Yayımlandığı Sayı Yıl 2018 Cilt: 2 Sayı: 2

Kaynak Göster

APA Selvaraj, T., Rajalingam, R., & Balasubramanian, V. (2018). Formation of 3-buten-1-ol over metal encapsulated ZSM-5 from formaldehyde and propene: A Density Functional Theory study. Turkish Computational and Theoretical Chemistry, 2(2), 28-35. https://doi.org/10.33435/tcandtc.429557
AMA Selvaraj T, Rajalingam R, Balasubramanian V. Formation of 3-buten-1-ol over metal encapsulated ZSM-5 from formaldehyde and propene: A Density Functional Theory study. Turkish Comp Theo Chem (TC&TC). Aralık 2018;2(2):28-35. doi:10.33435/tcandtc.429557
Chicago Selvaraj, Tamilmani, Renganathan Rajalingam, ve Viswanathan Balasubramanian. “Formation of 3-Buten-1-Ol over Metal Encapsulated ZSM-5 from Formaldehyde and Propene: A Density Functional Theory Study”. Turkish Computational and Theoretical Chemistry 2, sy. 2 (Aralık 2018): 28-35. https://doi.org/10.33435/tcandtc.429557.
EndNote Selvaraj T, Rajalingam R, Balasubramanian V (01 Aralık 2018) Formation of 3-buten-1-ol over metal encapsulated ZSM-5 from formaldehyde and propene: A Density Functional Theory study. Turkish Computational and Theoretical Chemistry 2 2 28–35.
IEEE T. Selvaraj, R. Rajalingam, ve V. Balasubramanian, “Formation of 3-buten-1-ol over metal encapsulated ZSM-5 from formaldehyde and propene: A Density Functional Theory study”, Turkish Comp Theo Chem (TC&TC), c. 2, sy. 2, ss. 28–35, 2018, doi: 10.33435/tcandtc.429557.
ISNAD Selvaraj, Tamilmani vd. “Formation of 3-Buten-1-Ol over Metal Encapsulated ZSM-5 from Formaldehyde and Propene: A Density Functional Theory Study”. Turkish Computational and Theoretical Chemistry 2/2 (Aralık 2018), 28-35. https://doi.org/10.33435/tcandtc.429557.
JAMA Selvaraj T, Rajalingam R, Balasubramanian V. Formation of 3-buten-1-ol over metal encapsulated ZSM-5 from formaldehyde and propene: A Density Functional Theory study. Turkish Comp Theo Chem (TC&TC). 2018;2:28–35.
MLA Selvaraj, Tamilmani vd. “Formation of 3-Buten-1-Ol over Metal Encapsulated ZSM-5 from Formaldehyde and Propene: A Density Functional Theory Study”. Turkish Computational and Theoretical Chemistry, c. 2, sy. 2, 2018, ss. 28-35, doi:10.33435/tcandtc.429557.
Vancouver Selvaraj T, Rajalingam R, Balasubramanian V. Formation of 3-buten-1-ol over metal encapsulated ZSM-5 from formaldehyde and propene: A Density Functional Theory study. Turkish Comp Theo Chem (TC&TC). 2018;2(2):28-35.
 Kapak Resmi İndir

Journal Full Title: Turkish Computational and Theoretical Chemistry


Journal Abbreviated Title: Turkish Comp Theo Chem (TC&TC)