Geometry & MOs

Info

ID:	20350
PubChem CID:	583260
Reduced:	SO4C40H78 (1)
Stoich.:	AB4C40D78 (1)
Weight, g/mol:	654.562082
ΔH_f, kcal/mol:	-343.38
Dipole, Da:	4.41
IP(EA), eV:	-9.11(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

octadecyl 2-(2-octadecoxy-2-oxoethyl)sulfanylacetate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCOC(=O)CSCC(=O)OCCCCCCCCCCCCCCCCCC

DOS

IR

Vibrations