Geometry & MOs

Info

ID:	414089
PubChem CID:	135087043
Reduced:	ON2H20C25 (1)
Stoich.:	AB2C20D25 (1)
Weight, g/mol:	223.097345
ΔH_f, kcal/mol:	97.49
Dipole, Da:	2.2
IP(EA), eV:	-8.44(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-diethoxyphosphoryl-N-methylpropan-1-imine oxide

Drug info:

PubChemData

Smile

CNC(=O)C1=C(C2=CC=CC=C2N1CC3=CC=CC=C3)C#CC4=CC=CC=C4

DOS

IR

Vibrations