3-[(4-Cyanobenzyl)Amino]-6-(Trifluoromethyl)-2-Quinoxalinecarboxylic Acid

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Properties Simple | Detailed

Formula C18H11F3N4O2
IUPAC Name 3-[(4-cyanophenyl)methylamino]-6-(trifluoromethyl)quinoxaline-2-carboxylic acid
Molecular Mass 372.301 g·mol−1
Heat of Formation -528.6 ± 16.7 kJ·mol−1
Dipole Moment 1.69 ± 1.08 D
Volume 394.28 Å 3
Surface Area 362.2 Å 2
HOMO Energy -9.24 ± 0.55 eV
LUMO Energy 0.97 ± eV
Point Group Symmetry C1
InChIKey RFEBDZANCVHDLP-UHFFFAOYSA-N
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