Geometry & MOs

Info

ID:	391144
PubChem CID:	135003073
Reduced:	N2O5H16C18 (1)
Stoich.:	A2B5C16D18 (1)
Weight, g/mol:	585.159768
ΔH_f, kcal/mol:	-48.13
Dipole, Da:	3.61
IP(EA), eV:	-8.9(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-[[2-[2-diethoxyphosphoryl-2-(4-fluorophenyl)acetyl]oxy-3-oxo-3-thiophen-2-ylpropanoyl]amino]propanoate

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)NC(C2C=CC(=O)O2)C3=CC=CC=C3)[N+](=O)[O-]

DOS

IR

Vibrations