Geometry & MOs

Info

ID:	161526
PubChem CID:	57391908
Reduced:	N4C13H16 (1)
Stoich.:	A4B13C16 (1)
Weight, g/mol:	237.078123
ΔH_f, kcal/mol:	60.01
Dipole, Da:	3.02
IP(EA), eV:	-9.0(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4,5-dihydro-1H-imidazol-2-ylmethyl)benzotriazole;hydrochloride

Drug info:

PubChemData

Smile

CCC1=NC2=CC=CC=C2N1CC3=NCCN3

DOS

IR

Vibrations