Geometry & MOs

Info

ID:	19559
PubChem CID:	567759
Reduced:	PSO5C10H19 (1)
Stoich.:	ABC5D10E19 (1)
Weight, g/mol:	282.069082
ΔH_f, kcal/mol:	-297.53
Dipole, Da:	4.26
IP(EA), eV:	-9.98(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-diethoxyphosphorylsulfanylbut-2-enoate

Drug info:

PubChemData

Smile

CCOC(=O)C=C(C)SP(=O)(OCC)OCC

DOS

IR

Vibrations