Geometry & MOs

Info

ID:	391260
PubChem CID:	135003940
Reduced:	BrOF3H10C12 (1)
Stoich.:	ABC3D10E12 (1)
Weight, g/mol:	329.13921
ΔH_f, kcal/mol:	-143.12
Dipole, Da:	2.9
IP(EA), eV:	-8.93(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[[diethoxyphosphoryl(phenyl)methyl]amino]acetate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C=C/C=C(/OCC(F)(F)F)\Br

DOS

IR

Vibrations