Geometry & MOs

Info

ID:	205231
PubChem CID:	80072890
Reduced:	ClON3C13H18 (1)
Stoich.:	ABC3D13E18 (1)
Weight, g/mol:	302.098604
ΔH_f, kcal/mol:	-29.37
Dipole, Da:	2.44
IP(EA), eV:	-9.11(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chloroethyl)-1-[(3-fluorophenyl)methyl]-6-methylbenzimidazole

Drug info:

PubChemData

Smile

CC1=C(C=CC=N1)C(=O)N2CCN(CC2)CCCl

DOS

IR

Vibrations