Formula |
C32H32ClNO4 |
IUPAC Name |
[4-[(3s,4r,5r)-3-(methoxymethyl)-5-(2-naphthylmethoxy)-4-piperidyl]phenyl]methyl 2-chlorobenzoate |
Molecular Mass |
530.054 g·mol−1 |
Heat of Formation |
-411.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.97 ± 1.08 D |
Volume |
631.33 Å 3 |
Surface Area |
457.49 Å 2 |
HOMO Energy |
-8.64 ± 0.55 eV |
LUMO Energy |
2.27 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
MDNCEOVGVRNOIK-NAYUSWPISA-N |
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Elements |
H
C
Cl
O
N
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