Geometry & MOs

Info

ID:	413453
PubChem CID:	135086402
Reduced:	PH2O2F4C6 (1)
Stoich.:	AB2C2D4E6 (1)
Weight, g/mol:	315.087174
ΔH_f, kcal/mol:	-199.63
Dipole, Da:	4.87
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 2.013746
Charge, e:	0

Chem-info

IUPAC name:

N-[1-dimethoxyphosphoryl-2-(4-methoxyphenyl)-2-oxoethyl]acetamide

Drug info:

PubChemData

Smile

C1=C(C(=C(C(=C1F)F)[P+](=O)O)F)F

DOS

IR

Vibrations