Geometry & MOs

Info

ID:	341930
PubChem CID:	127264623
Reduced:	ClFNC9H11 (1)
Stoich.:	ABCD9E11 (1)
Weight, g/mol:	173.060742
ΔH_f, kcal/mol:	-66.39
Dipole, Da:	2.83
IP(EA), eV:	-9.63(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1R)-1-aminoethyl]phenol;hydrochloride

Drug info:

PubChemData

Smile

C1CC2=C([C@H]1N)C(=CC=C2)F.Cl

DOS

IR

Vibrations