1-[(4-Methoxycyclohexyl)Methyl]-4-Oxo-5,6,7,8-Tetrahydro-2H-Quinoline-2,3,4A,5,6,7,8,8A-Octaide-3-Carboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C18H30NO4+ |
| IUPAC Name | (1s,3r,4as,8as)-1-[(4-methoxycyclohexyl)methyl]-4-oxo-2,3,4a,5,6,7,8,8a-octahydro-1h-quinolin-1-ium-3-carboxylic acid |
| Molecular Mass | 324.435 g·mol−1 |
| Heat of Formation | -420.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.85 ± 1.08 D |
| Volume | 354.61 Å 3 |
| Surface Area | 315.01 Å 2 |
| HOMO Energy | -8.98 ± 0.55 eV |
| LUMO Energy | 2.21 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ALTJYLAONIXTQQ-UHFFFAOYSA-O |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |