3-Isothiocyanato-4-Methoxy-1H-Indole

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Properties Simple | Detailed

Formula C10H8N2OS
IUPAC Name 3-isothiocyanato-4-methoxy-1h-indole
Molecular Mass 204.248 g·mol−1
Heat of Formation 168.2 ± 16.7 kJ·mol−1
Dipole Moment 5.00 ± 1.08 D
Volume 234.84 Å 3
Surface Area 223.51 Å 2
HOMO Energy -8.09 ± 0.55 eV
LUMO Energy 2.36 ± eV
Point Group Symmetry Cs
Synonyms
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  • 1
  • 3
  • 4
  • a
  • c
  • d
  • e
  • h
  • i
  • l
  • m
  • n
  • o
  • s
  • t
  • x
  • y
InChIKey DJDFPSQNQFBWJR-UHFFFAOYSA-N
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