Geometry & MOs

Info

ID:	72280
PubChem CID:	48416000
Reduced:	ON4C23H24 (1)
Stoich.:	AB4C23D24 (1)
Weight, g/mol:	391.150761
ΔH_f, kcal/mol:	45.77
Dipole, Da:	4.36
IP(EA), eV:	-8.58(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N-methyl-2-[2-(trifluoromethyl)phenoxy]acetamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)CC3=CC=C(C=C3)N4C=CC=C4

DOS

IR

Vibrations