Formula |
C14H17N3O3 |
IUPAC Name |
2-[(4r)-4-isopropyl-4-methyl-5-oxo-1h-imidazol-2-yl]-5-methyl-pyridine-3-carboxylic acid |
Molecular Mass |
275.303 g·mol−1 |
Heat of Formation |
-407.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.06 ± 1.08 D |
Volume |
332.7 Å 3 |
Surface Area |
286.94 Å 2 |
HOMO Energy |
-9.77 ± 0.55 eV |
LUMO Energy |
-1.30 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-[(4r)-4-isopropyl-4-methyl-5-oxo-1h-imidazol-2-yl]-5-methyl-3-pyridinecarboxylic acid
- 2-[(4r)-4-isopropyl-4-methyl-5-oxo-1h-imidazol-2-yl]-5-methyl-pyridine-3-carboxylic acid
- 2-[(4r)-4-isopropyl-5-keto-4-methyl-1h-imidazol-2-yl]-5-methyl-nicotinic acid
- 5-methyl-2-[(4r)-4-methyl-5-oxo-4-propan-2-yl-1h-imidazol-2-yl]pyridine-3-carboxylic acid
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InChIKey |
PVSGXWMWNRGTKE-CQSZACIVSA-N |
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Links |
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Downloads |
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Elements |
H
C
O
N
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