Geometry & MOs

Info

ID:	65938
PubChem CID:	46484614
Reduced:	NS3O4C13H17 (1)
Stoich.:	AB3C4D13E17 (1)
Weight, g/mol:	354.107185
ΔH_f, kcal/mol:	-136.92
Dipole, Da:	4.99
IP(EA), eV:	-9.3(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

O-propan-2-yl [2-(4-morpholin-4-ylanilino)-2-oxoethyl]sulfanylmethanethioate

Drug info:

PubChemData

Smile

CC(C)OC(=S)SCC(=O)NC1=CC=C(C=C1)S(=O)(=O)C

DOS

IR

Vibrations