Geometry & MOs

Info

ID:	72437
PubChem CID:	48416175
Reduced:	SN3O4C18H23 (1)
Stoich.:	AB3C4D18E23 (1)
Weight, g/mol:	373.188923
ΔH_f, kcal/mol:	-114.29
Dipole, Da:	4.27
IP(EA), eV:	-8.82(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=C(SN=N1)C(=O)NCC(CC2=CC=C(C=C2)OCC)C(=O)OC

DOS

IR

Vibrations