The reaction of isotope-substituted hydrated iodide I(H 182O)− with ozone: the reactive influence of the solvent water molecul

Henrik B. Pedersen; Jonas Elm; Christian H. Frederiksen; Simon P.S. Jessen; Ricky Teiwes; Merete Bilde

doi:10.1039/d0cp03219k

The reaction of isotope-substituted hydrated iodide I(H ¹⁸₂O)− with ozone: the reactive influence of the solvent water molecul

Henrik B. Pedersen, Jonas Elm, Christian H. Frederiksen, Simon P.S. Jessen, Ricky Teiwes, Merete Bilde

Publikation: Bidrag til tidsskrift/Konferencebidrag i tidsskrift /Bidrag til avis › Tidsskriftartikel › Forskning › peer review

4 Citationer (Scopus)

Abstract

We report an investigation of the reaction of isotope-substituted hydrated iodide I(H182O)- with ozone 16O3 to examine the involvement of the water molecules in the oxidation reactions that terminate with the formation of IO3-. Experimentally, we studied the reaction in the gas phase as elementary reactions using a radio-frequency (RF) ion-trap combined with a quadrupole mass spectrometer (QMS). In approximately 1.2% of the reactions of I(H182O)- and 16O3, the 18O atom is found to appear in iodine oxide anions, thus giving evidence for a close involvement of the water molecule in a non-negligible number of the reactions towards IO3-. As a part of the experimental investigation, the reaction rate constant for the exchange reaction I(H182O)- + H162O → I(H162O)- + H182O at 300 K was found to be (1.3 ± 0.1) × 10-8 cm3 s-1. Quantum chemical calculations are exploited to establish the energetic difference between I(H182O)- and I(H162O)-.

Originalsprog	Engelsk
Tidsskrift	Physical Chemistry Chemical Physics
Vol/bind	22
Nummer	34
Sider (fra-til)	19080-19088
Antal sider	9
ISSN	1463-9076
DOI	https://doi.org/10.1039/d0cp03219k
Status	Udgivet - sep. 2020

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10.1039/d0cp03219k

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http://www.scopus.com/inward/record.url?scp=85090869822&partnerID=8YFLogxK

Citationsformater

@article{8354dac34cbd453fb37625ab6303c97a,

title = "The reaction of isotope-substituted hydrated iodide I(H 182O)− with ozone: the reactive influence of the solvent water molecul",

abstract = "We report an investigation of the reaction of isotope-substituted hydrated iodide I(H182O)- with ozone 16O3 to examine the involvement of the water molecules in the oxidation reactions that terminate with the formation of IO3-. Experimentally, we studied the reaction in the gas phase as elementary reactions using a radio-frequency (RF) ion-trap combined with a quadrupole mass spectrometer (QMS). In approximately 1.2% of the reactions of I(H182O)- and 16O3, the 18O atom is found to appear in iodine oxide anions, thus giving evidence for a close involvement of the water molecule in a non-negligible number of the reactions towards IO3-. As a part of the experimental investigation, the reaction rate constant for the exchange reaction I(H182O)- + H162O → I(H162O)- + H182O at 300 K was found to be (1.3 ± 0.1) × 10-8 cm3 s-1. Quantum chemical calculations are exploited to establish the energetic difference between I(H182O)- and I(H162O)-.",

author = "Pedersen, {Henrik B.} and Jonas Elm and Frederiksen, {Christian H.} and Jessen, {Simon P.S.} and Ricky Teiwes and Merete Bilde",

year = "2020",

month = sep,

doi = "10.1039/d0cp03219k",

language = "English",

volume = "22",

pages = "19080--19088",

journal = "Physical Chemistry Chemical Physics",

issn = "1463-9076",

publisher = "Royal Society of Chemistry",

number = "34",

}

The reaction of isotope-substituted hydrated iodide I(H ¹⁸₂O)− with ozone: the reactive influence of the solvent water molecul. / Pedersen, Henrik B.; Elm, Jonas; Frederiksen, Christian H. et al.
I: Physical Chemistry Chemical Physics, Bind 22, Nr. 34, 09.2020, s. 19080-19088.

Publikation: Bidrag til tidsskrift/Konferencebidrag i tidsskrift /Bidrag til avis › Tidsskriftartikel › Forskning › peer review

TY - JOUR

T1 - The reaction of isotope-substituted hydrated iodide I(H 182O)− with ozone

T2 - the reactive influence of the solvent water molecul

AU - Pedersen, Henrik B.

AU - Elm, Jonas

AU - Frederiksen, Christian H.

AU - Jessen, Simon P.S.

AU - Teiwes, Ricky

AU - Bilde, Merete

PY - 2020/9

Y1 - 2020/9

N2 - We report an investigation of the reaction of isotope-substituted hydrated iodide I(H182O)- with ozone 16O3 to examine the involvement of the water molecules in the oxidation reactions that terminate with the formation of IO3-. Experimentally, we studied the reaction in the gas phase as elementary reactions using a radio-frequency (RF) ion-trap combined with a quadrupole mass spectrometer (QMS). In approximately 1.2% of the reactions of I(H182O)- and 16O3, the 18O atom is found to appear in iodine oxide anions, thus giving evidence for a close involvement of the water molecule in a non-negligible number of the reactions towards IO3-. As a part of the experimental investigation, the reaction rate constant for the exchange reaction I(H182O)- + H162O → I(H162O)- + H182O at 300 K was found to be (1.3 ± 0.1) × 10-8 cm3 s-1. Quantum chemical calculations are exploited to establish the energetic difference between I(H182O)- and I(H162O)-.

AB - We report an investigation of the reaction of isotope-substituted hydrated iodide I(H182O)- with ozone 16O3 to examine the involvement of the water molecules in the oxidation reactions that terminate with the formation of IO3-. Experimentally, we studied the reaction in the gas phase as elementary reactions using a radio-frequency (RF) ion-trap combined with a quadrupole mass spectrometer (QMS). In approximately 1.2% of the reactions of I(H182O)- and 16O3, the 18O atom is found to appear in iodine oxide anions, thus giving evidence for a close involvement of the water molecule in a non-negligible number of the reactions towards IO3-. As a part of the experimental investigation, the reaction rate constant for the exchange reaction I(H182O)- + H162O → I(H162O)- + H182O at 300 K was found to be (1.3 ± 0.1) × 10-8 cm3 s-1. Quantum chemical calculations are exploited to establish the energetic difference between I(H182O)- and I(H162O)-.

UR - http://www.scopus.com/inward/record.url?scp=85090869822&partnerID=8YFLogxK

U2 - 10.1039/d0cp03219k

DO - 10.1039/d0cp03219k

M3 - Journal article

C2 - 32814937

AN - SCOPUS:85090869822

SN - 1463-9076

VL - 22

SP - 19080

EP - 19088

JO - Physical Chemistry Chemical Physics

JF - Physical Chemistry Chemical Physics

IS - 34