Formula |
C19H30N4O5 |
IUPAC Name |
(3s,4r,5r)-4-acetamido-3-[4-(3-hydroxypropyl)triazol-1-yl]-5-pentan-3-yloxycyclohexene-1-carboxylic acid |
Molecular Mass |
394.465 g·mol−1 |
Heat of Formation |
-792.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.89 ± 1.08 D |
Volume |
491.16 Å 3 |
Surface Area |
414.49 Å 2 |
HOMO Energy |
-9.50 ± 0.55 eV |
LUMO Energy |
2.30 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
SRPAWFOAIVGZIY-RCCFBDPRSA-N |
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Elements |
H
C
O
N
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