Formula |
C19H30N4O5 |
IUPAC Name |
(3s,4r,5r)-4-acetamido-3-[4-(2-hydroxypropan-2-yl)triazol-1-yl]-5-pentan-3-yloxycyclohexene-1-carboxylic acid |
Molecular Mass |
394.465 g·mol−1 |
Heat of Formation |
-827.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
8.56 ± 1.08 D |
Volume |
491.36 Å 3 |
Surface Area |
403.0 Å 2 |
HOMO Energy |
-9.60 ± 0.55 eV |
LUMO Energy |
-0.75 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
SHZLGTIBAVWRQZ-ZMSDIMECSA-N |
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Elements |
H
C
O
N
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