2-Aminoethyl 2,6-Dimethyl-5-Nitro-4-[2-(Trifluoromethyl)Phenyl]-1,4-Dihydro-3-Pyridinecarboxylate

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Formula C17H10F3N3O4
IUPAC Name 2-[[(3e)-3-hydroxyimino-2-(oxomethylene)-4-[2-(trifluoromethyl)phenyl]-4,7-dihydrofuro[3,4-b]pyridin-1-ium-5-yl]oxy]acetonitrile
Molecular Mass 377.274 g·mol−1
Heat of Formation 1070.7 ± 16.7 kJ·mol−1
Dipole Moment 3.18 ± 1.08 D
Volume 374.58 Å 3
Surface Area 310.1 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy -2.31 ± eV
Point Group Symmetry C1
InChIKey RCJFYGYHESLEHK-CQSZACIVSA-N
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