2,4,6,8,9,10-Hexaoxa-1,3,5,7-tetraarsatricyclo[3.3.1.13,7]decane
- Formula: As4O6
- Molecular weight: 395.6828
- IUPAC Standard InChIKey: KTTMEOWBIWLMSE-UHFFFAOYSA-N
- CAS Registry Number: 12505-67-8
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Other names: 2,4,6,7,8,10-Hexaoxa-1,3,5,7-tetraarsatricyclo[3.3.1.13,7]decane; Arsentrioxid
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Gas phase ion energetics data
Go To: Top, Mass spectrum (electron ionization), References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled as indicated in comments:
LBLHLM - Sharon G. Lias, John E. Bartmess, Joel F. Liebman, John L. Holmes, Rhoda D. Levin, and W. Gary Mallard
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
10.3 ± 0.3 | EI | Brittain, Lau, et al., 1982 | LBLHLM |
10.05 | PE | Egdell, Palmer, et al., 1980 | Vertical value; LLK |
10.01 ± 0.05 | PE | Diemann, 1977 | Vertical value; LLK |
10.05 | PE | Cannington and Whitfield, 1977 | Vertical value; LLK |
Appearance energy determinations
Ion | AE (eV) | Other Products | Method | Reference | Comment |
---|---|---|---|---|---|
As2O3+ | 18.0 ± 1.0 | ? | EI | Brittain, Lau, et al., 1982 | LBLHLM |
As3O4+ | 13.0 ± 0.3 | ? | EI | Brittain, Lau, et al., 1982 | LBLHLM |
As4O5+ | 15.5 ± 0.5 | O | EI | Brittain, Lau, et al., 1982 | LBLHLM |
Mass spectrum (electron ionization)
Go To: Top, Gas phase ion energetics data, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director
Spectrum
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Additional Data
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Owner | NIST Mass Spectrometry Data Center Collection (C) 2014 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
---|---|
Origin | Humboldt-Universitat zu Berlin, Department of Chemistry, Analytical Group |
NIST MS number | 286555 |
References
Go To: Top, Gas phase ion energetics data, Mass spectrum (electron ionization), Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Brittain, Lau, et al., 1982
Brittain, R.D.; Lau, K.H.; Hildenbrand, D.L.,
Molecular species in the As-O system,
J. Phys. Chem., 1982, 86, 5072. [all data]
Egdell, Palmer, et al., 1980
Egdell, R.G.; Palmer, M.H.; Findlay, R.H.,
Electronic structure of the group 5 oxides: Photoelectron spectra and ab initio molecular orbital calculations,
Inorg. Chem., 1980, 19, 1314. [all data]
Diemann, 1977
Diemann, E.,
The orbital electronic structure of the As4O6 molecule by photoelectron spectroscopy,
Inorg. Chim. Acta, 1977, 24, 27. [all data]
Cannington and Whitfield, 1977
Cannington, P.H.; Whitfield, H.J.,
Photoelectron spectra of As4S3, P4S3, P4Se3, and As4O6,
J. Electron Spectrosc. Relat. Phenom., 1977, 10, 35. [all data]
Notes
Go To: Top, Gas phase ion energetics data, Mass spectrum (electron ionization), References
- Symbols used in this document:
AE Appearance energy - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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