Formula |
C18H21NO5 |
IUPAC Name |
4-[(1r)-2-[[(1r)-2-(1,3-benzodioxol-5-yl)-1-methyl-ethyl]amino]-1-hydroxy-ethyl]benzene-1,2-diol |
Molecular Mass |
331.363 g·mol−1 |
Heat of Formation |
-679.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.70 ± 1.08 D |
Volume |
399.33 Å 3 |
Surface Area |
313.73 Å 2 |
HOMO Energy |
-8.46 ± 0.55 eV |
LUMO Energy |
0.29 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
LUMAEVHDZXIGEP-BZNIZROVSA-N |
QR Code |
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Elements |
H
C
O
N
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