3-Methyl-2-[2'-(Methylsulfonyl)-4-Biphenylyl]-5-(Trifluoromethyl)Quinoxaline

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Properties Simple | Detailed

Formula C23H17F3N2O2S
IUPAC Name 3-methyl-2-[4-(2-methylsulfonylphenyl)phenyl]-5-(trifluoromethyl)quinoxaline
Molecular Mass 442.453 g·mol−1
Heat of Formation -587.4 ± 16.7 kJ·mol−1
Dipole Moment 7.11 ± 1.08 D
Volume 476.95 Å 3
Surface Area 397.35 Å 2
HOMO Energy -9.80 ± 0.55 eV
LUMO Energy 1.45 ± eV
Point Group Symmetry C1
InChIKey XRKIRPKDPBHBRD-UHFFFAOYSA-N
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