Formula |
C18H27N2O9P |
IUPAC Name |
[(3r)-4-[[3-[2-(1,3-benzodioxol-5-yl)ethylamino]-3-oxo-propyl]amino]-3-hydroxy-2,2-dimethyl-4-oxo-butyl] dihydrogen phosphate |
Molecular Mass |
446.389 g·mol−1 |
Heat of Formation |
-1879.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.78 ± 1.08 D |
Volume |
512.53 Å 3 |
Surface Area |
439.56 Å 2 |
HOMO Energy |
-8.78 ± 0.55 eV |
LUMO Energy |
-0.12 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
OQCPPROGRWYIDC-INIZCTEOSA-N |
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Elements |
P
C
H
O
N
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