Formula |
C7H7NO2 |
IUPAC Name |
1-(1-oxidopyridin-1-ium-3-yl)ethanone |
Molecular Mass |
137.136 g·mol−1 |
Heat of Formation |
-70.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
0.82 ± 1.08 D |
Volume |
161.47 Å 3 |
Surface Area |
165.42 Å 2 |
HOMO Energy |
-9.33 ± 0.55 eV |
LUMO Energy |
1.67 ± eV |
Point Group Symmetry |
Cs
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Synonyms
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- 1-(1-oxido-3-pyridin-1-iumyl)ethanone
- 1-(1-oxidopyridin-1-ium-3-yl)ethanone
- 1-(3-pyridinyl-1-oxide)ethanone
- 3-acetylpyridine n-oxide
- aj-333/36120037
- ethanone, 1-(3-pyridinyl)-, n-oxide
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CAS Number(s) |
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InChIKey |
AZFMFGIMDGBJRR-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
O
N
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