Geometry & MOs

Info

ID:	24693
PubChem CID:	612304
Reduced:	ClNPO3C15H17 (1)
Stoich.:	ABCD3E15F17 (1)
Weight, g/mol:	325.063458
ΔH_f, kcal/mol:	-139.88
Dipole, Da:	3.19
IP(EA), eV:	-8.27(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[dimethoxyphosphoryl(phenyl)methyl]aniline

Drug info:

PubChemData

Smile

COP(=O)(C(C1=CC=CC=C1)NC2=CC=C(C=C2)Cl)OC

DOS

IR

Vibrations