5H-Pyrimido[5,4-B]Indole

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Properties Simple | Detailed

Formula C10H7N3
IUPAC Name 5h-pyrimido[5,4-b]indole
Molecular Mass 169.183 g·mol−1
Heat of Formation 328.7 ± 16.7 kJ·mol−1
Dipole Moment 4.29 ± 1.08 D
Volume 193.95 Å 3
Surface Area 190.59 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy 2.05 ± eV
Point Group Symmetry Cs
Synonyms
  • 9h-2,4,9-triaza-fluorene
  • bas 03148576
InChIKey IADMQABXGAXDPF-UHFFFAOYSA-N
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Elements H C N