Geometry & MOs

Info

ID:	398129
PubChem CID:	135031915
Reduced:	O4H14C19 (1)
Stoich.:	A4B14C19 (1)
Weight, g/mol:	363.114044
ΔH_f, kcal/mol:	-77.91
Dipole, Da:	2.97
IP(EA), eV:	-9.29(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2R)-3-(4-methoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanoate

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C3=C(C(C(=C)O3)C4=CC=CC=C4)C(=O)O2

DOS

IR

Vibrations