Geometry & MOs

Info

ID:	9379
PubChem CID:	88761
Reduced:	ClN3H4C6 (1)
Stoich.:	AB3C4D6 (1)
Weight, g/mol:	153.009375
ΔH_f, kcal/mol:	106.6
Dipole, Da:	4.22
IP(EA), eV:	-9.55(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chlorobenzotriazole

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=NN2Cl

DOS

IR

Vibrations