Ro 6-4563

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Formula C18H26N2O4S
IUPAC Name 1-[(1s,2s,3r,4r)-3-hydroxy-4,7,7-trimethyl-norbornan-2-yl]-3-(p-tolylsulfonyl)urea
Molecular Mass 366.475 g·mol−1
Heat of Formation -729.2 ± 16.7 kJ·mol−1
Dipole Moment 7.24 ± 1.08 D
Volume 433.09 Å 3
Surface Area 354.6 Å 2
HOMO Energy -9.56 ± 0.55 eV
LUMO Energy -0.64 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[(1r,4s,5s,6r)-6-hydroxy-1,7,7-trimethyl-5-bicyclo[2.2.1]heptanyl]-3-(4-methylphenyl)sulfonyl-urea
  • 1-[(1r,4s,5s,6r)-6-hydroxy-1,7,7-trimethyl-5-bicyclo[2.2.1]heptanyl]-3-(4-methylphenyl)sulfonylurea
  • 1-[(1s,2s,3r,4r)-3-hydroxy-4,7,7-trimethyl-2-norbornanyl]-3-(4-methylphenyl)sulfonylurea
  • 1-[(1s,2s,3r,4r)-3-hydroxy-4,7,7-trimethyl-norbornan-2-yl]-3-(4-methylphenyl)sulfonyl-urea
InChIKey RMTYNAPTNBJHQI-LLDVTBCESA-N
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