Cariporide

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Properties Simple | Detailed

Formula C12H17N3O3S
IUPAC Name n-(diaminomethylene)-4-isopropyl-3-methylsulfonyl-benzamide
Molecular Mass 283.347 g·mol−1
Heat of Formation -459.0 ± 16.7 kJ·mol−1
Dipole Moment 4.75 ± 1.08 D
Volume 324.81 Å 3
Surface Area 293.34 Å 2
HOMO Energy -9.78 ± 0.55 eV
LUMO Energy 2.35 ± eV
Point Group Symmetry C1
Synonyms
  • benzamide, n-(aminoiminomethyl)-4-(1-methylethyl)-3-(methylsulfonyl)-
  • n-(aminoiminomethyl)-4-(1-methylethyl)-3-(methylsulfonyl)benzamide
  • n-(diaminomethylene)-4-isopropyl-3-mesyl-benzamide
  • n-(diaminomethylene)-4-isopropyl-3-methylsulfonyl-benzamide
  • n-(diaminomethylene)-4-isopropyl-3-methylsulfonylbenzamide
  • n-(diaminomethylidene)-3-methylsulfonyl-4-propan-2-yl-benzamide
  • n-(diaminomethylidene)-3-methylsulfonyl-4-propan-2-ylbenzamide
CAS Number(s)
  • 159138-80-4
InChIKey IWXNYAIICFKCTM-UHFFFAOYSA-N
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