Geometry & MOs

Info

ID:	148456
PubChem CID:	53788118
Reduced:	N2O3H16C20 (1)
Stoich.:	A2B3C16D20 (1)
Weight, g/mol:	509.15797
ΔH_f, kcal/mol:	-27.95
Dipole, Da:	3.71
IP(EA), eV:	-8.25(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-acetamido-3-(3-diethoxyphosphoryl-4-diethoxyphosphoryloxyphenyl)propanoate

Drug info:

PubChemData

Smile

COC1=C(NC=C1)C=C2C3=C(C=CC=C3NC2=O)C4=CC=C(C=C4)O

DOS

IR

Vibrations