Geometry & MOs

Info

ID:	10949
PubChem CID:	109347
Reduced:	PS2O6C28H55 (1)
Stoich.:	AB2C6D28E55 (1)
Weight, g/mol:	582.317769
ΔH_f, kcal/mol:	-411.51
Dipole, Da:	2.33
IP(EA), eV:	-8.42(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dibutyl 2-[bis(2-ethylhexoxy)phosphinothioylsulfanyl]butanedioate

Drug info:

PubChemData

Smile

CCCCC(CC)COP(=S)(OCC(CC)CCCC)SC(CC(=O)OCCCC)C(=O)OCCCC

DOS

IR

Vibrations