Geometry & MOs

Info

ID:	352111
PubChem CID:	127283179
Reduced:	SN4O4H16C17 (1)
Stoich.:	AB4C4D16E17 (1)
Weight, g/mol:	397.167142
ΔH_f, kcal/mol:	-91.24
Dipole, Da:	7.34
IP(EA), eV:	-9.04(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-2-oxoethyl]-8,8-dioxo-8lambda6-thia-1,3-diazaspiro[4.5]decane-2,4-dione

Drug info:

PubChemData

Smile

C1CS(=O)(=O)CCC12C(=O)N(C(=O)N2)CC3=CN4C=CC=CC4=C3C#N

DOS

IR

Vibrations