Geometry & MOs

Info

ID:	261370
PubChem CID:	103228962
Reduced:	ClFNO2C11H15 (1)
Stoich.:	ABCD2E11F15 (1)
Weight, g/mol:	287.05209
ΔH_f, kcal/mol:	-114.7
Dipole, Da:	3.78
IP(EA), eV:	-9.04(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromo-3-methylphenoxy)-3-methoxy-N-methylpropan-1-amine

Drug info:

PubChemData

Smile

CNCC(COC)OC1=CC(=C(C=C1)Cl)F

DOS

IR

Vibrations