Geometry & MOs

Info

ID:	72039
PubChem CID:	48415743
Reduced:	FON3C19H20 (1)
Stoich.:	ABC3D19E20 (1)
Weight, g/mol:	377.135111
ΔH_f, kcal/mol:	-31.63
Dipole, Da:	7.64
IP(EA), eV:	-9.14(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N-methyl-4-(trifluoromethoxy)benzamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)CC3=CC=CC=C3F

DOS

IR

Vibrations