Geometry & MOs

Info

ID:	48687
PubChem CID:	11110505
Reduced:	N3O4H15C18 (1)
Stoich.:	A3B4C15D18 (1)
Weight, g/mol:	337.165425
ΔH_f, kcal/mol:	-48.44
Dipole, Da:	5.51
IP(EA), eV:	-9.74(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[tert-butyl-(2-diethoxyphosphorylacetyl)amino]propanoate

Drug info:

PubChemData

Smile

CCO/C(=C(/C(=O)N(C1=CC=CC=C1)C(=O)C2=CC=CC=C2)\[N+]#N)/[O-]

DOS

IR

Vibrations