N~1~-[4-(1,1,1,2,3,3,3-Heptafluorpropan-2-Yl)-2-Methylphenyl]-3-Iod-N~2~-[2-Methyl-1-(Methylsulfonyl)Propan-2-Yl]Phthalamid

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Properties Simple | Detailed

Formula C23H22F7IN2O4S
IUPAC Name n2-(1,1-dimethyl-2-methylsulfonyl-ethyl)-3-iodo-n1-[2-methyl-4-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]phenyl]phthalamide
Molecular Mass 682.390 g·mol−1
Heat of Formation -2038.8 ± 16.7 kJ·mol−1
Dipole Moment 10.30 ± 1.08 D
Volume 634.6 Å 3
Surface Area 478.02 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy -0.97 ± eV
Point Group Symmetry C1
Synonyms
  • flubendiamide
  • n(2)-[1,1-dimethyl-2-(methylsulfonyl)ethyl]-3-iodo-n(1)-{2-methyl-4-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]phenyl}benzene-1,2-dicarboxamide
  • n(2)-[1,1-dimethyl-2-(methylsulfonyl)ethyl]-3-iodo-n(1)-{2-methyl-4-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]phenyl}phthalamide
CAS Number(s)
  • 272451-65-7
InChIKey ZGNITFSDLCMLGI-UHFFFAOYSA-N
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