Geometry & MOs

Info

ID:	72137
PubChem CID:	48415849
Reduced:	ON3C21H25 (1)
Stoich.:	AB3C21D25 (1)
Weight, g/mol:	393.205242
ΔH_f, kcal/mol:	2.82
Dipole, Da:	6.47
IP(EA), eV:	-9.15(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-4-(4-ethoxyphenyl)-N-methyl-4-oxobutanamide

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)C(=O)N(C)CCCC2=NC3=CC=CC=C3N2

DOS

IR

Vibrations