Geometry & MOs

Info

ID:	72530
PubChem CID:	48416274
Reduced:	N2O5C21H30 (1)
Stoich.:	A2B5C21D30 (1)
Weight, g/mol:	402.179087
ΔH_f, kcal/mol:	-203.66
Dipole, Da:	5.48
IP(EA), eV:	-9.09(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(4-ethoxyphenyl)methyl]-3-[3-(furan-3-carbonylamino)propanoylamino]propanoate

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CC(CNC(=O)CCCNC(=O)C2CC2)C(=O)OC

DOS

IR

Vibrations