Formula |
C9H10N2O3 |
IUPAC Name |
5-methyl-4-oxo-6,7-dihydropyrrolo[3,4-c]pyridin-2-ium-3-ylium-3-carboxylic acid |
Molecular Mass |
194.187 g·mol−1 |
Heat of Formation |
-416.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.85 ± 1.08 D |
Volume |
216.32 Å 3 |
Surface Area |
208.83 Å 2 |
HOMO Energy |
-9.04 ± 0.55 eV |
LUMO Energy |
-0.47 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 4-keto-5-methyl-6,7-dihydro-2h-pyrrolo[3,4-c]pyridine-3-carboxylic acid
- 5-methyl-4-oxo-6,7-dihydro-2h-pyrrolo[3,4-c]pyridine-3-carboxylic acid
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InChIKey |
PTBJVLGXDFOMFM-UHFFFAOYSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
C
O
N
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