Geometry & MOs

Info

ID:	414044
PubChem CID:	135086997
Reduced:	NO2F3H12C13 (1)
Stoich.:	AB2C3D12E13 (1)
Weight, g/mol:	366.092891
ΔH_f, kcal/mol:	-216.22
Dipole, Da:	4.2
IP(EA), eV:	-9.13(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

ethoxy-[1-[(4-methylphenyl)sulfonylamino]-2-phenylethyl]-oxophosphanium

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC2=C(N1C)C=CC(=C2)C(F)(F)F

DOS

IR

Vibrations