Geometry & MOs

Info

ID:	125931
PubChem CID:	50944206
Reduced:	OCl2N3C9H13 (1)
Stoich.:	AB2C3D9E13 (1)
Weight, g/mol:	195.056325
ΔH_f, kcal/mol:	-86.2
Dipole, Da:	2.75
IP(EA), eV:	-8.48(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-imidazol-1-ylaniline;hydrochloride

Drug info:

PubChemData

Smile

CC(C1=NC2=C(N1)C=C(C=C2)N)O.Cl.Cl

DOS

IR

Vibrations