Geometry & MOs

Info

ID:	196889
PubChem CID:	78890679
Reduced:	O2F3N3H20C22 (1)
Stoich.:	A2B3C3D20E22 (1)
Weight, g/mol:	359.01571
ΔH_f, kcal/mol:	-165.43
Dipole, Da:	6.67
IP(EA), eV:	-9.26(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-bromo-2-methylphenyl)-7-methoxy-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)OC2=NC=C(C=C2)CNC(=O)C3=C(C4=CC=CC=C4N=C3)C(F)(F)F

DOS

IR

Vibrations