Geometry & MOs

Info

ID:	338794
PubChem CID:	127259805
Reduced:	SO3H14C15 (1)
Stoich.:	AB3C14D15 (1)
Weight, g/mol:	361.180857
ΔH_f, kcal/mol:	-79.99
Dipole, Da:	4.79
IP(EA), eV:	-9.66(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(diethylamino)-1-phenylpropyl] 2-phenylacetate;hydrochloride

Drug info:

PubChemData

Smile

CC1=C(SC=C1C=O)C2=CC=CC=C2C(C)C(=O)O

DOS

IR

Vibrations