Geometry & MOs

Info

ID:	131900
PubChem CID:	51276312
Reduced:	SN2O5C18H26 (1)
Stoich.:	AB2C5D18E26 (1)
Weight, g/mol:	341.162708
ΔH_f, kcal/mol:	-190.25
Dipole, Da:	7.43
IP(EA), eV:	-9.21(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[3-(2-hydroxyphenyl)propanoylamino]-3-(4-methylphenyl)propanoate

Drug info:

PubChemData

Smile

CN(C1CCCC1)C(=O)CCNS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

DOS

IR

Vibrations