1,3,4,6,7,9,9B-Heptaazaphenalene-2,5,8-Triamine

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Properties Simple | Detailed

Formula C6H6N10
IUPAC Name 1,3,4,6,7,9,9b-heptaazaphenalene-2,5,8-triamine
Molecular Mass 218.179 g·mol−1
Heat of Formation 459.4 ± 16.7 kJ·mol−1
Dipole Moment 0.01 ± 1.08 D
Volume 217.34 Å 3
Surface Area 214.65 Å 2
HOMO Energy -9.51 ± 0.55 eV
LUMO Energy 0.86 ± eV
Point Group Symmetry D3h
Synonyms
  • 1,3,4,6,7,9,9b-heptaaza-phenalene-2,5,8-triamine
  • 1,3,4,6,7,9,9b-heptaazaphenalene, 2,5,8-triamino- (6ci,7ci,8ci)
  • 2,5,8-triamino-1,3,4,6,7,9,9b-heptaaza-phenalene
  • 2,5,8-triamino-tri-s-triazine
  • bas 00721838
  • cyamelurotriamide
  • melem
  • triamino-s-heptazine
CAS Number(s)
  • 1502-47-2
InChIKey YSRVJVDFHZYRPA-UHFFFAOYSA-N
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