Oxygen evolution from BF3/MnO4-

Shek Man Yiu; Wai Lun Man; Xin Wang; William W.Y. Lam; Siu Mui Ng; Hoi Ki Kwong; Kai Chung Lau; Tai Chu Lau

doi:10.1039/c1cc00019e

Oxygen evolution from BF₃/MnO₄^-

Shek Man Yiu, Wai Lun Man, Xin Wang, William W.Y. Lam, Siu Mui Ng, Hoi Ki Kwong, Kai Chung Lau, Tai Chu Lau

Research output: Contribution to journal › Article › peer-review

13 Citations (Scopus)

Abstract

MnO₄^- is activated by BF₃ to undergo intramolecular coupling of two oxo ligands to generate O₂. DFT calculations suggest that there should be a spin intercrossing between the singlet and triplet potential energy surfaces on going from the active intermediate [MnO₂(OBF₃)₂]^- to the O⋯O coupling transition state.

Original language	English
Pages (from-to)	4159-4161
Number of pages	3
Journal	Chemical Communications
Volume	47
Issue number	14
DOIs	https://doi.org/10.1039/c1cc00019e
Publication status	Published - 22 Mar 2011
Externally published	Yes

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@article{188e0faf6eba4ed99df21ffe0407c70f,

title = "Oxygen evolution from BF3/MnO4-",

abstract = "MnO4- is activated by BF3 to undergo intramolecular coupling of two oxo ligands to generate O2. DFT calculations suggest that there should be a spin intercrossing between the singlet and triplet potential energy surfaces on going from the active intermediate [MnO2(OBF3)2]- to the O⋯O coupling transition state.",

author = "Yiu, {Shek Man} and Man, {Wai Lun} and Xin Wang and Lam, {William W.Y.} and Ng, {Siu Mui} and Kwong, {Hoi Ki} and Lau, {Kai Chung} and Lau, {Tai Chu}",

year = "2011",

month = mar,

day = "22",

doi = "10.1039/c1cc00019e",

language = "English",

volume = "47",

pages = "4159--4161",

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TY - JOUR

T1 - Oxygen evolution from BF3/MnO4-

AU - Yiu, Shek Man

AU - Man, Wai Lun

AU - Wang, Xin

AU - Lam, William W.Y.

AU - Ng, Siu Mui

AU - Kwong, Hoi Ki

AU - Lau, Kai Chung

AU - Lau, Tai Chu

PY - 2011/3/22

Y1 - 2011/3/22

N2 - MnO4- is activated by BF3 to undergo intramolecular coupling of two oxo ligands to generate O2. DFT calculations suggest that there should be a spin intercrossing between the singlet and triplet potential energy surfaces on going from the active intermediate [MnO2(OBF3)2]- to the O⋯O coupling transition state.

AB - MnO4- is activated by BF3 to undergo intramolecular coupling of two oxo ligands to generate O2. DFT calculations suggest that there should be a spin intercrossing between the singlet and triplet potential energy surfaces on going from the active intermediate [MnO2(OBF3)2]- to the O⋯O coupling transition state.

UR - http://www.scopus.com/inward/record.url?scp=79954992139&partnerID=8YFLogxK

U2 - 10.1039/c1cc00019e

DO - 10.1039/c1cc00019e

M3 - Article

C2 - 21359340

AN - SCOPUS:79954992139

SN - 1359-7345

VL - 47

SP - 4159

EP - 4161

JO - Chemical Communications

JF - Chemical Communications

IS - 14

ER -

Oxygen evolution from BF₃/MnO₄^-

Abstract

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