Geometry & MOs

Info

ID:	144322
PubChem CID:	53350405
Reduced:	ClNO2C17H25 (1)
Stoich.:	ABC2D17E25 (1)
Weight, g/mol:	285.115851
ΔH_f, kcal/mol:	-66.56
Dipole, Da:	2.34
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.750058
Charge, e:	-1

Chem-info

IUPAC name:

2-ethyl-1-(2-phenylethyl)benzimidazole;chloride

Drug info:

PubChemData

Smile

CC(CN1CCCCC1)OC(=O)CCC2=CC=CC=C2.[Cl-]

DOS

IR

Vibrations