Clobetasol

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Formula C22H28ClFO4
IUPAC Name (8s,9r,10s,11s,13s,14s,16s,17r)-17-(2-chloroacetyl)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
Molecular Mass 410.907 g·mol−1
Heat of Formation -967.6 ± 16.7 kJ·mol−1
Dipole Moment 6.40 ± 1.08 D
Volume 462.09 Å 3
Surface Area 350.48 Å 2
HOMO Energy -9.81 ± 0.55 eV
LUMO Energy -0.43 ± eV
Point Group Symmetry C1
Synonyms
  • (8s,9r,10s,11s,13s,14s,16s,17r)-17-(2-chloro-1-oxoethyl)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
  • (8s,9r,10s,11s,13s,14s,16s,17r)-17-(2-chloroacetyl)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
  • (8s,9r,10s,11s,13s,14s,16s,17r)-17-(2-chloroethanoyl)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
InChIKey FCSHDIVRCWTZOX-DVTGEIKXSA-N
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Elements H C F O Cl