Geometry & MOs

Info

ID:	132195
PubChem CID:	51318652
Reduced:	N2S2O4C17H18 (1)
Stoich.:	A2B2C4D17E18 (1)
Weight, g/mol:	388.182064
ΔH_f, kcal/mol:	-112.23
Dipole, Da:	5.11
IP(EA), eV:	-8.27(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-adamantyl)-N-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]acetamide

Drug info:

PubChemData

Smile

C1CN(S(=O)(=O)C1)C2=CC=C(C=C2)NC(=O)CCC(=O)C3=CC=CS3

DOS

IR

Vibrations