Geometry & MOs

Info

ID:	196847
PubChem CID:	78885806
Reduced:	BrNO3C17H20 (1)
Stoich.:	ABC3D17E20 (1)
Weight, g/mol:	297.136493
ΔH_f, kcal/mol:	-65.74
Dipole, Da:	1.45
IP(EA), eV:	-8.14(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(7-methoxy-1-benzofuran-2-yl)methyl]-2-(methoxymethyl)aniline

Drug info:

PubChemData

Smile

COCC1=CC=CC=C1NCC2=CC(=C(C=C2Br)OC)OC

DOS

IR

Vibrations