Geometry & MOs

Info

ID:	261366
PubChem CID:	103228758
Reduced:	ClN2O2C11H17 (1)
Stoich.:	AB2C2D11E17 (1)
Weight, g/mol:	229.086957
ΔH_f, kcal/mol:	-62.74
Dipole, Da:	3.09
IP(EA), eV:	-9.27(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-chlorophenyl)methoxy]-3-methoxypropan-1-amine

Drug info:

PubChemData

Smile

CCNCC(COC)OC1=CC(=CN=C1)Cl

DOS

IR

Vibrations