Geometry & MOs

Info

ID:	71962
PubChem CID:	48415662
Reduced:	O2N4C21H24 (1)
Stoich.:	A2B4C21D24 (1)
Weight, g/mol:	337.179027
ΔH_f, kcal/mol:	-40.12
Dipole, Da:	8.7
IP(EA), eV:	-8.6(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(NC2=C1C(=O)CCC2)C(=O)N(C)CCCC3=NC4=CC=CC=C4N3

DOS

IR

Vibrations