Geometry & MOs

Info

ID:	71998
PubChem CID:	48415700
Reduced:	OSN4C22H24 (1)
Stoich.:	ABC4D22E24 (1)
Weight, g/mol:	336.195011
ΔH_f, kcal/mol:	27.27
Dipole, Da:	1.77
IP(EA), eV:	-8.94(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-4-(dimethylamino)-N-methylbenzamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)CCCC3=NC4=CC=CC=C4S3

DOS

IR

Vibrations