3-[(2E)-2-(2,6-Dichlorobenzylidene)Hydrazino]-4H-1,2,4-Triazol-4-Amine

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Properties Simple | Detailed

Formula C9H8Cl2N6
IUPAC Name n3-[(e)-(2,6-dichlorophenyl)methyleneamino]-1,2,4-triazole-3,4-diamine
Molecular Mass 271.106 g·mol−1
Heat of Formation 541.0 ± 16.7 kJ·mol−1
Dipole Moment 7.33 ± 1.08 D
Volume 285.02 Å 3
Surface Area 268.57 Å 2
HOMO Energy -9.39 ± 0.55 eV
LUMO Energy 1.23 ± eV
Point Group Symmetry C1
Synonyms
  • (4-amino-1,2,4-triazol-3-yl)-[(2,6-dichlorobenzylidene)amino]amine
  • 2,6-dichlorobenzaldehyde (4-amino-4h-1,2,4-triazol-3-yl)hydrazone
  • fla 136
  • fla-136
  • h 113/75
  • n-[(2,6-dichlorophenyl)methyleneamino]-1,2,4-triazole-3,4-diamine
  • nebidrazine
CAS Number(s)
  • 55248-23-2
InChIKey KHCYGOIWSWLPNL-YIXHJXPBSA-N
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Elements H C N Cl