Geometry & MOs

Info

ID:	336658
PubChem CID:	127255665
Reduced:	SO3C7H8 (1)
Stoich.:	AB3C7D8 (1)
Weight, g/mol:	201.092042
ΔH_f, kcal/mol:	-108.21
Dipole, Da:	3.34
IP(EA), eV:	-9.53(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-4-phenylbutan-1-ol;hydrochloride

Drug info:

PubChemData

Smile

CC(=O)C1=CC=C(S1)C(O)O

DOS

IR

Vibrations