N-{[(2R)-1-Ethyl-2-Pyrrolidinyl]Methyl}-5-(Ethylsulfonyl)-2-Methoxybenzamide

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Properties Simple | Detailed

Formula C17H26N2O4S
IUPAC Name n-[[(1s,2r)-1-ethylpyrrolidin-2-yl]methyl]-5-ethylsulfonyl-2-methoxy-benzamide
Molecular Mass 354.464 g·mol−1
Heat of Formation -651.8 ± 16.7 kJ·mol−1
Dipole Moment 8.64 ± 1.08 D
Volume 429.38 Å 3
Surface Area 371.93 Å 2
HOMO Energy -8.92 ± 0.55 eV
LUMO Energy -0.56 ± eV
Point Group Symmetry C1
InChIKey UNRHXEPDKXPRTM-CYBMUJFWSA-N
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