N-[(E)-[4-(Benzyloxy)Phenyl](Methyl)-Lambda~4~-Sulfanylidene]-4-Methylbenzenesulfonamide

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Properties Simple | Detailed

Formula C21H21NO3S2
IUPAC Name (ne)-n-[(4-benzyloxyphenyl)-methyl-λ4-sulfanylidene]-4-methyl-benzenesulfonamide
Molecular Mass 399.526 g·mol−1
Heat of Formation -146.5 ± 16.7 kJ·mol−1
Dipole Moment 4.96 ± 1.08 D
Volume 459.65 Å 3
Surface Area 409.6 Å 2
HOMO Energy -8.80 ± 0.55 eV
LUMO Energy 2.77 ± eV
Point Group Symmetry C1
Synonyms
  • 4-methyl-n-[(r)-methyl-[4-(phenylmethoxy)phenyl]-$l^{4}-sulfanylidene]benzenesulfonamide
  • n-[(r)-[4-(benzyloxy)phenyl]-methyl-$l^{4}-sulfanylidene]-4-methyl-benzenesulfonamide
InChIKey IMUPOWQOXOCVBN-AREMUKBSSA-N
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