3-[[(1R,2S,4As,8Ar)-1,2,4A,5-Tetramethyl-1,3,4,7,8,8A-Hexahydronaphthalen-2-Yl]Methyl]-5-Amino-4-Hydroxy-1,2-Benzoquinone
Properties
| Property | Value |
|---|---|
| Formula | C21H29NO3 |
| IUPAC Name | 3-[[(1r,2s,4as,8ar)-1,2,4a,5-tetramethyl-1,3,4,7,8,8a-hexahydronaphthalen-2-yl]methyl]-5-amino-4-hydroxy-1,2-benzoquinone |
| Molecular Mass | 343.460 g·mol−1 |
| Heat of Formation | -495.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.99 ± 1.08 D |
| Volume | 429.59 Å 3 |
| Surface Area | 336.15 Å 2 |
| HOMO Energy | -9.22 ± 0.55 eV |
| LUMO Energy | -1.27 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YPHRSJYIWCYOQA-XOIYUPORSA-N |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |