Formula |
C23H25Cl2NO4 |
IUPAC Name |
2-[(3r,5r,6s)-5-(3-chlorophenyl)-6-(4-chlorophenyl)-1-[(1s)-1-(hydroxymethyl)propyl]-2-oxo-3-piperidyl]acetic acid |
Molecular Mass |
450.355 g·mol−1 |
Heat of Formation |
-736.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.61 ± 1.08 D |
Volume |
521.37 Å 3 |
Surface Area |
395.25 Å 2 |
HOMO Energy |
-9.49 ± 0.55 eV |
LUMO Energy |
-0.74 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
MUYVUHCWOCMQPD-CJXUKZFBSA-N |
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Elements |
H
C
N
O
Cl
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