Geometry & MOs

Info

ID:	72388
PubChem CID:	48416117
Reduced:	NSO4C20H25 (1)
Stoich.:	ABC4D20E25 (1)
Weight, g/mol:	346.152872
ΔH_f, kcal/mol:	-154.24
Dipole, Da:	2.36
IP(EA), eV:	-8.67(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(4-ethoxyphenyl)methyl]-3-[(3-methyl-1,2-oxazole-5-carbonyl)amino]propanoate

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CC(CNC(=O)C2=C(SC(=C2)C)C)C(=O)OC

DOS

IR

Vibrations