Geometry & MOs

Info

ID:	72387
PubChem CID:	48416116
Reduced:	NO4C20H27 (1)
Stoich.:	AB4C20D27 (1)
Weight, g/mol:	375.150429
ΔH_f, kcal/mol:	-162.09
Dipole, Da:	4.44
IP(EA), eV:	-8.72(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CC(CNC(=O)CC2CCC=C2)C(=O)OC

DOS

IR

Vibrations