Geometry & MOs

Info

ID:	290555
PubChem CID:	104644036
Reduced:	NO4C15H23 (1)
Stoich.:	AB4C15D23 (1)
Weight, g/mol:	294.157957
ΔH_f, kcal/mol:	-161.29
Dipole, Da:	3.88
IP(EA), eV:	-9.15(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[1-(3-acetamidophenyl)ethylamino]-2-hydroxy-2-methylpropanoate

Drug info:

PubChemData

Smile

CCOCC1=CC=CC=C1CNCC(C)(C(=O)OC)O

DOS

IR

Vibrations