Fludioxonil

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Properties Simple | Detailed

Formula C12H6F2N2O2
IUPAC Name 4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1h-pyrrole-3-carbonitrile
Molecular Mass 248.185 g·mol−1
Heat of Formation -383.1 ± 16.7 kJ·mol−1
Dipole Moment 6.75 ± 1.08 D
Volume 259.53 Å 3
Surface Area 243.79 Å 2
HOMO Energy -9.69 ± 0.55 eV
LUMO Energy -0.87 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-pyrrole-3-carbonitrile, 4-(2,2-difluoro-1,3-benzodioxol-4-yl)-
CAS Number(s)
  • 131341-86-1
InChIKey MUJOIMFVNIBMKC-UHFFFAOYSA-N
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