Geometry & MOs

Info

ID:	341920
PubChem CID:	127264613
Reduced:	ClNO3C10H14 (1)
Stoich.:	ABC3D10E14 (1)
Weight, g/mol:	231.102607
ΔH_f, kcal/mol:	-153.1
Dipole, Da:	0.57
IP(EA), eV:	-9.33(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-(3,5-dimethoxyphenyl)propan-1-amine;hydrochloride

Drug info:

PubChemData

Smile

COC(=O)C[C@H](C1=CC(=CC=C1)O)N.Cl

DOS

IR

Vibrations