Cyclic O4 2+: Metastable and aromatic

R. W.A. Havenith; P. W. Fowler

doi:10.1080/00268970601040968

Cyclic O₄ ²⁺: Metastable and aromatic

R. W.A. Havenith^*
, P. W. Fowler

^*Corresponding author voor dit werk

Onderzoeksoutput › Academic › peer review

1 Citaat (Scopus)

Samenvatting

Mapping of induced current density within the ipsocentric approach for [image omitted] shows that this 6 electron system has the HOMO-dominated diatropic ring current expected of a typical aromatic molecule, in spite of its high internal energy.

Originele taal-2	English
Pagina's (van-tot)	3161-3165
Aantal pagina's	5
Tijdschrift	Molecular Physics
Volume	104
Nummer van het tijdschrift	20-21
DOI's	https://doi.org/10.1080/00268970601040968
Status	Published - okt.-2006
Extern gepubliceerd	Ja

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title = "Cyclic O4 2+: Metastable and aromatic",

abstract = "Mapping of induced current density within the ipsocentric approach for [image omitted] shows that this 6 electron system has the HOMO-dominated diatropic ring current expected of a typical aromatic molecule, in spite of its high internal energy.",

author = "Havenith, \{R. W.A.\} and Fowler, \{P. W.\}",

note = "Funding Information: R. W. A. H. acknowledges financial support from the Netherlands Organisation for Scientific Research (NWO), grant 700.53.401, and P. W. F. acknowledges financial support from the Royal Society/Wolfson Research Merit Award Scheme. We gratefully acknowledge NWO/NCF for supercomputer time on TERAS/ ASTER, SARA (The Netherlands, project number SG-032).",

year = "2006",

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doi = "10.1080/00268970601040968",

language = "English",

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T2 - Metastable and aromatic

AU - Havenith, R. W.A.

AU - Fowler, P. W.

N1 - Funding Information: R. W. A. H. acknowledges financial support from the Netherlands Organisation for Scientific Research (NWO), grant 700.53.401, and P. W. F. acknowledges financial support from the Royal Society/Wolfson Research Merit Award Scheme. We gratefully acknowledge NWO/NCF for supercomputer time on TERAS/ ASTER, SARA (The Netherlands, project number SG-032).

PY - 2006/10

Y1 - 2006/10

N2 - Mapping of induced current density within the ipsocentric approach for [image omitted] shows that this 6 electron system has the HOMO-dominated diatropic ring current expected of a typical aromatic molecule, in spite of its high internal energy.

AB - Mapping of induced current density within the ipsocentric approach for [image omitted] shows that this 6 electron system has the HOMO-dominated diatropic ring current expected of a typical aromatic molecule, in spite of its high internal energy.

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DO - 10.1080/00268970601040968

M3 - Article

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SN - 0026-8976

VL - 104

SP - 3161

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JO - Molecular Physics

JF - Molecular Physics

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