N-{[1-(Cyclopropylmethyl)-2-Pyrrolidinyl]Methyl}-5-(Ethylsulfonyl)-4-Iodo-2-Methoxybenzamide

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Formula C19H27IN2O4S
IUPAC Name n-[[(1r,2r)-1-(cyclopropylmethyl)pyrrolidin-2-yl]methyl]-5-ethylsulfonyl-4-iodo-2-methoxy-benzamide
Molecular Mass 506.398 g·mol−1
Heat of Formation -464.9 ± 16.7 kJ·mol−1
Dipole Moment 7.19 ± 1.08 D
Volume 506.95 Å 3
Surface Area 424.71 Å 2
HOMO Energy -8.73 ± 0.55 eV
LUMO Energy -0.86 ± eV
Point Group Symmetry C1
InChIKey QICCKJBXMXZXJQ-CQSZACIVSA-N
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