Geometry & MOs

Info

ID:	398218
PubChem CID:	135032342
Reduced:	NS2O7C19H23 (1)
Stoich.:	AB2C7D19E23 (1)
Weight, g/mol:	385.020928
ΔH_f, kcal/mol:	-244.3
Dipole, Da:	6.6
IP(EA), eV:	-8.85(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

O-ethyl [5-chloro-1-(1,3-dioxoisoindol-2-yl)-4-oxopentyl]sulfanylmethanethioate

Drug info:

PubChemData

Smile

CCOC(=S)SC(CC(C(OC)OC)C(=O)OC)N1C(=O)C2=CC=CC=C2C1=O

DOS

IR

Vibrations