Ethyl 7-Isobutyl-6-(2-Methoxyethoxy)-4-Oxo-1,2,5,8-Tetrahydroquinoline-2,3,4A,5,6,7,8,8A-Octaide-3-Carboxylate
Properties
Property | Value |
---|---|
Formula | C19H34NO5+ |
IUPAC Name | ethyl (3r,4ar,6s,7s,8ar)-7-isobutyl-6-(2-methoxyethoxy)-4-oxo-2,3,4a,5,6,7,8,8a-octahydro-1h-quinolin-1-ium-3-carboxylate |
Molecular Mass | 356.477 g·mol−1 |
Heat of Formation | -808.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.33 ± 1.08 D |
Volume | 424.81 Å 3 |
Surface Area | 369.04 Å 2 |
HOMO Energy | -8.60 ± 0.55 eV |
LUMO Energy | 2.38 ± eV |
Point Group Symmetry | C1 |
InChIKey | GGSFOQCGJMNNEJ-UHFFFAOYSA-O |
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Elements | H C O N |