Sertraline

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Properties Simple | Detailed

Formula C17H17Cl2N
IUPAC Name (1s,4s)-4-(3,4-dichlorophenyl)-n-methyl-tetralin-1-amine
Molecular Mass 306.230 g·mol−1
Heat of Formation 88.6 ± 16.7 kJ·mol−1
Dipole Moment 4.40 ± 1.08 D
Volume 354.48 Å 3
Surface Area 308.41 Å 2
HOMO Energy -8.98 ± 0.55 eV
LUMO Energy -0.45 ± eV
Point Group Symmetry C1
Synonyms
  • (1s,4s)-4-(3,4-dichlorophenyl)-n-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
  • (1s,4s)-4-(3,4-dichlorophenyl)-n-methyl-1-tetralinamine
  • (1s,4s)-4-(3,4-dichlorophenyl)-n-methyl-tetralin-1-amine
  • (1s-cis)-1,2,3,4-tetrahydro-4-(3,4-dichlorophenyl)-n-methyl-1-naphthalenamine
  • 1-naphthalenamine, 1,2,3,4-tetrahydro-4-(3,4-dichlorophenyl)-n-methyl-, (1s-cis)-
  • [(1s,4s)-4-(3,4-dichlorophenyl)tetralin-1-yl]-methyl-amine
  • bpbio1_001285
  • cp 51974
  • d02360
  • ks-1111
  • sertralina [spanish]
  • sertralinum [latin]
CAS Number(s)
  • 79617-96-2
InChIKey VGKDLMBJGBXTGI-SJCJKPOMSA-N
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Elements H C N Cl