Geometry & MOs

Info

ID:	260783
PubChem CID:	103204038
Reduced:	NC3H4 (4)
Stoich.:	AB3C4 (4)
Weight, g/mol:	270.067224
ΔH_f, kcal/mol:	61.83
Dipole, Da:	2.05
IP(EA), eV:	-8.81(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-chlorophenyl)methyl]-1,2,4-benzotriazin-3-amine

Drug info:

PubChemData

Smile

CCCCCNC1=NC2=CC=CC=C2N=N1

DOS

IR

Vibrations