Geometry & MOs

Info

ID:	71911
PubChem CID:	48415609
Reduced:	FON3C20H22 (1)
Stoich.:	ABC3D20E22 (1)
Weight, g/mol:	393.124405
ΔH_f, kcal/mol:	-38.74
Dipole, Da:	4.8
IP(EA), eV:	-9.16(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-5-(2-chlorophenyl)-N-methylfuran-2-carboxamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)CCC3=CC=CC=C3F

DOS

IR

Vibrations