Geometry & MOs

Info

ID:	23046
PubChem CID:	601334
Reduced:	OSN2C18H20 (1)
Stoich.:	ABC2D18E20 (1)
Weight, g/mol:	312.129634
ΔH_f, kcal/mol:	18.07
Dipole, Da:	2.05
IP(EA), eV:	-8.36(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-2-[2-(4-methylphenoxy)ethylsulfanyl]benzimidazole

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2N=C1SCCOC3=CC=C(C=C3)C

DOS

IR

Vibrations