2-[(2H-Benzotriazol-5-Ylamino)Methyl]-4,6-Dichlorophenol

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Properties Simple | Detailed

Formula C13H10Cl2N4O
IUPAC Name 2-[(benzotriazol-5-ylamino)methyl]-4,6-dichloro-phenol
Molecular Mass 309.151 g·mol−1
Heat of Formation 203.2 ± 16.7 kJ·mol−1
Dipole Moment 3.00 ± 1.08 D
Volume 324.76 Å 3
Surface Area 299.53 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy -1.09 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[(2h-benzotriazol-5-ylamino)methyl]-4,6-dichloro-phenol
InChIKey QEHVTUCLCBXQIC-UHFFFAOYSA-N
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Elements H C N O Cl