Geometry & MOs

Info

ID:	72525
PubChem CID:	48416269
Reduced:	N2O6C19H28 (1)
Stoich.:	A2B6C19D28 (1)
Weight, g/mol:	408.226037
ΔH_f, kcal/mol:	-268.46
Dipole, Da:	6.41
IP(EA), eV:	-8.84(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[[2-(ethoxycarbonylamino)-3-methylbutanoyl]amino]methyl]-3-(4-ethoxyphenyl)propanoate

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CC(CNC(=O)CCNC(=O)OCC)C(=O)OC

DOS

IR

Vibrations