N-[(3S)-1-Amino-1,2-Dioxo-3-Pentanyl]-2-Chloro-4-(2-Pyridinylmethoxy)-3-(Trifluoromethyl)Benzamide

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Properties Simple | Detailed

Formula C19H17ClF3N3O4
IUPAC Name n-[(1s)-3-amino-1-ethyl-2,3-dioxo-propyl]-2-chloro-4-(2-pyridylmethoxy)-3-(trifluoromethyl)benzamide
Molecular Mass 443.804 g·mol−1
Heat of Formation -1185.7 ± 16.7 kJ·mol−1
Dipole Moment 5.72 ± 1.08 D
Volume 463.39 Å 3
Surface Area 398.15 Å 2
HOMO Energy -9.76 ± 0.55 eV
LUMO Energy 1.68 ± eV
Point Group Symmetry C1
InChIKey VMSZYKRQEOLBRN-LBPRGKRZSA-N
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