Geometry & MOs

Info

ID:	424393
PubChem CID:	135122522
Reduced:	N2O3H12C13 (1)
Stoich.:	A2B3C12D13 (1)
Weight, g/mol:	283.158372
ΔH_f, kcal/mol:	-78.86
Dipole, Da:	9.91
IP(EA), eV:	-8.59(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(fluoromethyl)-3-(2-phenylmethoxyethylamino)propanoate

Drug info:

PubChemData

Smile

CN1C2=C(C=C(C=C2)N)C=C(C1=O)/C=C/C(=O)O

DOS

IR

Vibrations