Geometry & MOs

Info

ID:	295400
PubChem CID:	117528023
Reduced:	N3C17H19 (1)
Stoich.:	A3B17C19 (1)
Weight, g/mol:	256.076726
ΔH_f, kcal/mol:	50.54
Dipole, Da:	2.72
IP(EA), eV:	-8.44(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(chloromethyl)-1-methyl-2-phenylbenzimidazole

Drug info:

PubChemData

Smile

CC(C)C1=NC2=C(N1C)C=C(C=C2)C3=CC(=CC=C3)N

DOS

IR

Vibrations