Geometry & MOs

Info

ID:	385066
PubChem CID:	134978246
Reduced:	PS2O5C23H29 (1)
Stoich.:	AB2C5D23E29 (1)
Weight, g/mol:	480.119403
ΔH_f, kcal/mol:	-268.15
Dipole, Da:	1.63
IP(EA), eV:	-9.18(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(1-ethoxy-1-oxo-3-phenylpropan-2-yl)sulfanyl-methylphosphoryl]sulfanyl-3-phenylpropanoate

Drug info:

PubChemData

Smile

CCOC(=O)CC(C1=CC=CC=C1)SP(=O)(C)SC(CC(=O)OCC)C2=CC=CC=C2

DOS

IR

Vibrations