Geometry & MOs

Info

ID:	205814
PubChem CID:	80162037
Reduced:	BrClON3H9C13 (1)
Stoich.:	ABCD3E9F13 (1)
Weight, g/mol:	253.121512
ΔH_f, kcal/mol:	31.16
Dipole, Da:	3.83
IP(EA), eV:	-8.12(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-phenylethoxy)-3H-benzimidazol-5-amine

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1N)NC(=N2)OC3=C(C=C(C=C3)Cl)Br

DOS

IR

Vibrations