1-(2,6-Diisopropylphenyl)-3-{4-[(4-Nitrophenyl)Sulfanyl]Phenyl}Urea

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Properties Simple | Detailed

Formula C25H27N3O3S
IUPAC Name 1-(2,6-diisopropylphenyl)-3-[4-(4-nitrophenyl)sulfanylphenyl]urea
Molecular Mass 449.565 g·mol−1
Heat of Formation -33.1 ± 16.7 kJ·mol−1
Dipole Moment 8.49 ± 1.08 D
Volume 545.57 Å 3
Surface Area 464.75 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy 1.75 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(2,6-diisopropylphenyl)-3-[4-[(4-nitrophenyl)thio]phenyl]urea
InChIKey XFFITGBWVLQNCD-UHFFFAOYSA-N
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