N-(3-Iodo-4-Methylphenyl)-2-Pyrazinecarboxamide

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Properties Simple | Detailed

Formula C12H10IN3O
IUPAC Name n-(3-iodo-4-methyl-phenyl)pyrazine-1,4-diium-2-carboxamide
Molecular Mass 339.132 g·mol−1
Heat of Formation 160.6 ± 16.7 kJ·mol−1
Dipole Moment 2.26 ± 1.08 D
Volume 288.95 Å 3
Surface Area 273.98 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy -1.49 ± eV
Point Group Symmetry C1
Synonyms
  • n-(3-iodo-4-methyl-phenyl)pyrazinamide
  • n-(3-iodo-4-methyl-phenyl)pyrazine-2-carboxamide
  • t5734641
InChIKey ZOHCWOGHVXCJGH-UHFFFAOYSA-N
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