Geometry & MOs

Info

ID:	130290
PubChem CID:	51075521
Reduced:	NSO4C16H17 (1)
Stoich.:	ABC4D16E17 (1)
Weight, g/mol:	349.098394
ΔH_f, kcal/mol:	-121.56
Dipole, Da:	1.43
IP(EA), eV:	-9.21(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[[2-(4-methoxyphenoxy)acetyl]amino]-3-thiophen-2-ylpropanoate

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(=O)NC(CC(=O)OC)C2=CC=CS2

DOS

IR

Vibrations