Geometry & MOs

Info

ID:	216808
PubChem CID:	85086807
Reduced:	O5C17H20 (1)
Stoich.:	A5B17C20 (1)
Weight, g/mol:	304.035674
ΔH_f, kcal/mol:	-137.75
Dipole, Da:	5.9
IP(EA), eV:	-9.38(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[benzyl(sulfanyl)phosphinothioyl]oxypropanoate

Drug info:

PubChemData

Smile

COC1C=C(OC(C1OC)OC)C(=O)C=CC2=CC=CC=C2

DOS

IR

Vibrations