Confined benzene within InOF-1: Contrasting CO2 and SO2 capture behaviours

Luz J. Barrios-Vargas; José G. Ruiz-Montoya; Bruno Landeros-Rivera; J. Raziel Álvarez; Daniel Alvarado-Alvarado; Rubicelia Vargas; Ana Martínez; Eduardo González-Zamora; Ludy M. Cáceres; Juan C. Morales; Ilich A. Ibarra

doi:10.1039/c9dt04667d

Confined benzene within InOF-1: Contrasting CO₂ and SO₂ capture behaviours

Luz J. Barrios-Vargas
, José G. Ruiz-Montoya
, Bruno Landeros-Rivera
, J. Raziel Álvarez
, Daniel Alvarado-Alvarado
, Rubicelia Vargas
, Ana Martínez
, Eduardo González-Zamora
, Ludy M. Cáceres
, Juan C. Morales
, Ilich A. Ibarra

Research output: Contribution to journal › Article (Contribution to Journal) › peer-review

13 Scopus citations

Abstract

The confinement of small amounts of benzene in InOF-1 (Bz@InOF-1) shows a contradictory behavior in the capture of CO₂ and SO₂. While the capture of CO₂ is increased 1.6 times, compared to the pristine material, the capture of SO₂ shows a considerable decrease. To elucidate these behaviors, the interactions of CO₂ and SO₂ with Bz@InOF-1 were studied by DFT periodical calculations postulating a plausible explanation: (a) in the case of benzene and CO₂, these molecules do not compete for the preferential adsorption sites within InOF-1, providing a cooperative CO₂ capture enhancement and (b) benzene and SO₂ strongly compete for these preferential adsorption sites inside the MOF material, reducing the total SO₂ capture.

Original language	English
Pages (from-to)	2786-2793
Number of pages	8
Journal	Dalton Transactions
Volume	49
Issue number	9
DOIs	https://doi.org/10.1039/c9dt04667d https://doi.org/10.1039/C9DT04667D
State	Published - 7 Mar 2020

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Barrios-Vargas, L. J., Ruiz-Montoya, J. G., Landeros-Rivera, B., Álvarez, J. R., Alvarado-Alvarado, D., Vargas, R., Martínez, A., González-Zamora, E., Cáceres, L. M., Morales, J. C., & Ibarra, I. A. (2020). Confined benzene within InOF-1: Contrasting CO₂ and SO₂ capture behaviours. Dalton Transactions, 49(9), 2786-2793. https://doi.org/10.1039/c9dt04667d, https://doi.org/10.1039/C9DT04667D

@article{c4e83fadce7345c4b8a1249858a75aec,

title = "Confined benzene within InOF-1: Contrasting CO2 and SO2 capture behaviours",

abstract = "The confinement of small amounts of benzene in InOF-1 (Bz@InOF-1) shows a contradictory behavior in the capture of CO2 and SO2. While the capture of CO2 is increased 1.6 times, compared to the pristine material, the capture of SO2 shows a considerable decrease. To elucidate these behaviors, the interactions of CO2 and SO2 with Bz@InOF-1 were studied by DFT periodical calculations postulating a plausible explanation: (a) in the case of benzene and CO2, these molecules do not compete for the preferential adsorption sites within InOF-1, providing a cooperative CO2 capture enhancement and (b) benzene and SO2 strongly compete for these preferential adsorption sites inside the MOF material, reducing the total SO2 capture.",

author = "Barrios-Vargas, \{Luz J.\} and Ruiz-Montoya, \{Jos{\'e} G.\} and Bruno Landeros-Rivera and {\'A}lvarez, \{J. Raziel\} and Daniel Alvarado-Alvarado and Rubicelia Vargas and Ana Mart{\'i}nez and Eduardo Gonz{\'a}lez-Zamora and C{\'a}ceres, \{Ludy M.\} and Morales, \{Juan C.\} and Ibarra, \{Ilich A.\}",

note = "Publisher Copyright: This journal is {\textcopyright} The Royal Society of Chemistry.",

year = "2020",

month = mar,

day = "7",

doi = "10.1039/c9dt04667d",

language = "Ingl{\'e}s",

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Barrios-Vargas, LJ, Ruiz-Montoya, JG, Landeros-Rivera, B, Álvarez, JR, Alvarado-Alvarado, D, Vargas, R, Martínez, A, González-Zamora, E, Cáceres, LM , Morales, JC & Ibarra, IA 2020, 'Confined benzene within InOF-1: Contrasting CO₂ and SO₂ capture behaviours', Dalton Transactions, vol. 49, no. 9, pp. 2786-2793. https://doi.org/10.1039/c9dt04667d, https://doi.org/10.1039/C9DT04667D

TY - JOUR

T1 - Confined benzene within InOF-1

T2 - Contrasting CO2 and SO2 capture behaviours

AU - Barrios-Vargas, Luz J.

AU - Ruiz-Montoya, José G.

AU - Landeros-Rivera, Bruno

AU - Álvarez, J. Raziel

AU - Alvarado-Alvarado, Daniel

AU - Vargas, Rubicelia

AU - Martínez, Ana

AU - González-Zamora, Eduardo

AU - Cáceres, Ludy M.

AU - Morales, Juan C.

AU - Ibarra, Ilich A.

PY - 2020/3/7

Y1 - 2020/3/7

N2 - The confinement of small amounts of benzene in InOF-1 (Bz@InOF-1) shows a contradictory behavior in the capture of CO2 and SO2. While the capture of CO2 is increased 1.6 times, compared to the pristine material, the capture of SO2 shows a considerable decrease. To elucidate these behaviors, the interactions of CO2 and SO2 with Bz@InOF-1 were studied by DFT periodical calculations postulating a plausible explanation: (a) in the case of benzene and CO2, these molecules do not compete for the preferential adsorption sites within InOF-1, providing a cooperative CO2 capture enhancement and (b) benzene and SO2 strongly compete for these preferential adsorption sites inside the MOF material, reducing the total SO2 capture.

AB - The confinement of small amounts of benzene in InOF-1 (Bz@InOF-1) shows a contradictory behavior in the capture of CO2 and SO2. While the capture of CO2 is increased 1.6 times, compared to the pristine material, the capture of SO2 shows a considerable decrease. To elucidate these behaviors, the interactions of CO2 and SO2 with Bz@InOF-1 were studied by DFT periodical calculations postulating a plausible explanation: (a) in the case of benzene and CO2, these molecules do not compete for the preferential adsorption sites within InOF-1, providing a cooperative CO2 capture enhancement and (b) benzene and SO2 strongly compete for these preferential adsorption sites inside the MOF material, reducing the total SO2 capture.

UR - https://hdl.handle.net/20.500.12724/10676

UR - https://www.scopus.com/pages/publications/85081137778

U2 - 10.1039/c9dt04667d

DO - 10.1039/c9dt04667d

M3 - Artículo (Contribución a Revista)

C2 - 32043501

AN - SCOPUS:85081137778

SN - 1477-9226

VL - 49

SP - 2786

EP - 2793

JO - Dalton Transactions

JF - Dalton Transactions

IS - 9

ER -

Confined benzene within InOF-1: Contrasting CO₂ and SO₂ capture behaviours

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