Formula |
C19H20N2O2S |
IUPAC Name |
1-[(3-amino-2-methyl-phenyl)methyl]-4-[2-(3h-thiophen-1-ium-3-id-2-yl)ethoxy]pyridin-2-one |
Molecular Mass |
340.439 g·mol−1 |
Heat of Formation |
-94.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.61 ± 1.08 D |
Volume |
407.11 Å 3 |
Surface Area |
359.11 Å 2 |
HOMO Energy |
-8.46 ± 0.55 eV |
LUMO Energy |
-0.30 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 1-(3-amino-2-methyl-benzyl)-4-[2-(2-thienyl)ethoxy]-2-pyridone
- 1-[(3-amino-2-methyl-phenyl)methyl]-4-(2-thiophen-2-ylethoxy)pyridin-2-one
- 1-[(3-amino-2-methylphenyl)methyl]-4-(2-thiophen-2-ylethoxy)pyridin-2-one
- 1-[(3-amino-2-methylphenyl)methyl]-4-[2-(2-thienyl)ethoxy]-2-pyridinone
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InChIKey |
YCLREGRRHGLOAK-UHFFFAOYSA-N |
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Links |
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DOI |
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Downloads |
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Elements |
H
S
C
O
N
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