Mometasone

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Formula C22H28Cl2O4
IUPAC Name (8s,9r,10s,11s,13s,14s,16r,17r)-9-chloro-17-(2-chloroacetyl)-11,17-dihydroxy-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
Molecular Mass 427.361 g·mol−1
Heat of Formation -838.9 ± 16.7 kJ·mol−1
Dipole Moment 4.18 ± 1.08 D
Volume 481.9 Å 3
Surface Area 361.44 Å 2
HOMO Energy -9.85 ± 0.55 eV
LUMO Energy -0.48 ± eV
Point Group Symmetry C1
Synonyms
  • (8s,9r,10s,11s,13s,14s,16r,17r)-9-chloro-17-(2-chloro-1-oxoethyl)-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,16r,17r)-9-chloro-17-(2-chloroacetyl)-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,16r,17r)-9-chloro-17-(2-chloroethanoyl)-11,17-dihydroxy-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
CAS Number(s)
  • 105102-22-5
InChIKey QLIIKPVHVRXHRI-CXSFZGCWSA-N
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