Formula |
C18H19NO3 |
IUPAC Name |
[(z)-(5-isopropyl-2-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)amino] 2-methylbenzoate |
Molecular Mass |
297.348 g·mol−1 |
Heat of Formation |
-185.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.45 ± 1.08 D |
Volume |
373.11 Å 3 |
Surface Area |
328.32 Å 2 |
HOMO Energy |
-9.71 ± 0.55 eV |
LUMO Energy |
-1.43 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-methylbenzoic acid [(5-isopropyl-2-methyl-4-oxo-1-cyclohexa-2,5-dienylidene)amino] ester
- 2-methylbenzoic acid [(5-isopropyl-4-keto-2-methyl-1-cyclohexa-2,5-dienylidene)amino] ester
- [(2-methyl-4-oxo-5-propan-2-yl-1-cyclohexa-2,5-dienylidene)amino] 2-methylbenzoate
- [(5-isopropyl-2-methyl-4-oxo-1-cyclohexa-2,5-dienylidene)amino] 2-methylbenzoate
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InChIKey |
CMOJHDQJJPIVEC-MNDPQUGUSA-N |
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Links |
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Elements |
H
C
O
N
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