3-Amino-2,3-Dihydro-4H-[1,2,3]Triazino[5,4-B]Indol-4-One

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Properties Simple | Detailed

Formula C9H7N5O
IUPAC Name 3-amino-2h-triazino[5,4-b]indol-4-one
Molecular Mass 201.185 g·mol−1
Heat of Formation 460.6 ± 16.7 kJ·mol−1
Dipole Moment 2.48 ± 1.08 D
Volume 216.03 Å 3
Surface Area 210.17 Å 2
HOMO Energy -9.14 ± 0.55 eV
LUMO Energy 0.17 ± eV
Point Group Symmetry C1
Synonyms
  • 2-benzyliden-1-(3-aminoindol)-2-carbohydrazide
  • 3-amino-2h-[1,2,3]triazino[5,6-b]indol-4-one
  • 3-amino-5h-1,2,3-triazin(5,4-b)indol-4-one
  • 3-amino-5h-1,2,3-triazin(5,4b)indol-4-one
CAS Number(s)
  • 135086-97-4
InChIKey DGBPUSDRECMGFB-UHFFFAOYSA-N
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