Geometry & MOs

Info

ID:	143729
PubChem CID:	53253223
Reduced:	NPSF3O8C24H27 (1)
Stoich.:	ABCD3E8F24G27 (1)
Weight, g/mol:	543.088353
ΔH_f, kcal/mol:	-536.9
Dipole, Da:	5.52
IP(EA), eV:	-9.14(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(3-chlorophenyl)-2-[4-[(2,4-dioxo-1,3-thiazolidin-5-yl)methyl]phenoxy]ethoxy]propyl dimethyl phosphate

Drug info:

PubChemData

Smile

CCOP(=O)(OCC)OCOC(COC1=CC=C(C=C1)CC2C(=O)NC(=O)S2)C3=CC=C(C=C3)C(F)(F)F

DOS

IR

Vibrations