Geometry & MOs

Info

ID:	205212
PubChem CID:	80069662
Reduced:	N2O2C11H18 (1)
Stoich.:	A2B2C11D18 (1)
Weight, g/mol:	299.118925
ΔH_f, kcal/mol:	-80.18
Dipole, Da:	4.39
IP(EA), eV:	-9.01(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-chloroethyl)-6-methyl-1-[(6-methylpyridin-2-yl)methyl]benzimidazole

Drug info:

PubChemData

Smile

CC1=NC(=C(C=C1)OC(C)C(C)O)CN

DOS

IR

Vibrations