Rizatriptan

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Properties Simple | Detailed

Formula C15H19N5
IUPAC Name 2-[5-(4-aza-1-azonia-2-azanidacyclopenta-3,5-dien-1-ylmethyl)indol-3-yl]-n,n-dimethyl-ethanamine
Molecular Mass 269.345 g·mol−1
Heat of Formation 364.4 ± 16.7 kJ·mol−1
Dipole Moment 4.47 ± 1.08 D
Volume 343.89 Å 3
Surface Area 308.01 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy -0.48 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-indole-3-ethanamine, n,n-dimethyl-5-(1h-1,2,4-triazol-1-ylmethyl)-
  • dimethyl-[2-[5-(1,2,4-triazol-1-ylmethyl)-1h-indol-3-yl]ethyl]amine
  • mk 462 free base
  • n,n-dimethyl-2-[5-(1,2,4-triazol-1-ylmethyl)-1h-indol-3-yl]ethanamine
  • n,n-dimethyl-2-[5-(1h-1,2,4-triazol-1-ylmethyl)-1h-indol-3-yl]ethanamine
  • n,n-dimethyl-5-(1h-1,2,4-triazol-1-ylmethyl)-1h-indole-3-ethanamine
  • risatriptan
CAS Number(s)
  • 144034-80-0
InChIKey ULFRLSNUDGIQQP-UHFFFAOYSA-N
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