Geometry & MOs

Info

ID:	289604
PubChem CID:	104360036
Reduced:	BrNO2C17H18 (1)
Stoich.:	ABC2D17E18 (1)
Weight, g/mol:	312.04734
ΔH_f, kcal/mol:	-30.62
Dipole, Da:	3.06
IP(EA), eV:	-8.76(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-bromo-2,3-dihydro-1-benzofuran-7-yl)methylamino]-2-methylpropanamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CNCC2=CC(=CC3=C2OCC3)Br

DOS

IR

Vibrations