2-[(4-Methylphenyl)Amino]-5-Nitro-N-(Pentylcarbamoyl)Benzenesulfonamide

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Properties Simple | Detailed

Formula C19H24N4O5S
IUPAC Name 1-[2-(4-methylanilino)-5-nitro-phenyl]sulfonyl-3-pentyl-urea
Molecular Mass 420.483 g·mol−1
Heat of Formation -516.7 ± 16.7 kJ·mol−1
Dipole Moment 11.31 ± 1.08 D
Volume 490.28 Å 3
Surface Area 388.69 Å 2
HOMO Energy -8.99 ± 0.55 eV
LUMO Energy 1.86 ± eV
Point Group Symmetry C1
Synonyms
  • 1-amyl-3-[2-[(4-methylphenyl)amino]-5-nitro-phenyl]sulfonyl-urea
  • 3-[2-[(4-methylphenyl)amino]-5-nitro-phenyl]sulfonyl-1-pentyl-urea
  • n-pentyl-n'-[2-(4'methylphenylamino)-5-nitrobenzenesulfonyl] urea
InChIKey ZXEYXJKZEQUHBP-UHFFFAOYSA-N
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