Geometry & MOs

Info

ID:	341962
PubChem CID:	127264655
Reduced:	ClNO2C11H16 (1)
Stoich.:	ABC2D11E16 (1)
Weight, g/mol:	217.086957
ΔH_f, kcal/mol:	-79.27
Dipole, Da:	2.87
IP(EA), eV:	-9.2(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-2-[3-(methoxymethyl)phenyl]ethanol;hydrochloride

Drug info:

PubChemData

Smile

C1CC1OC2=CC=C(C=C2)[C@@H](CO)N.Cl

DOS

IR

Vibrations