Geometry & MOs

Info

ID:	71883
PubChem CID:	48415573
Reduced:	SO3N4C21H24 (1)
Stoich.:	AB3C4D21E24 (1)
Weight, g/mol:	297.147727
ΔH_f, kcal/mol:	-63.97
Dipole, Da:	5.74
IP(EA), eV:	-8.84(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N,2-dimethylfuran-3-carboxamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3=CC4=C(C=C3)N(CC4)S(=O)(=O)C

DOS

IR

Vibrations