Geometry & MOs

Info

ID:	410458
PubChem CID:	135083255
Reduced:	PSN2O2Cl3F3H5C8 (1)
Stoich.:	ABC2D2E3F3G5H8 (1)
Weight, g/mol:	622.213378
ΔH_f, kcal/mol:	-248.69
Dipole, Da:	2.87
IP(EA), eV:	-10.01(-1.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-[(4-methoxyphenyl)-(N-triphenylphosphaniumylanilino)methylidene]amino]-(4-nitrophenyl)azanide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)S(=O)(=O)/N=C(/C(F)(F)F)\N=P(Cl)(Cl)Cl

DOS

IR

Vibrations