Geometry & MOs

Info

ID:	366166
PubChem CID:	127319575
Reduced:	NS2O3C13H17 (1)
Stoich.:	AB2C3D13E17 (1)
Weight, g/mol:	321.139865
ΔH_f, kcal/mol:	-97.24
Dipole, Da:	7.51
IP(EA), eV:	-9.35(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide

Drug info:

PubChemData

Smile

C1CC(CS(=O)(=O)C1)NC(=O)C2=C(C=CS2)C3CC3

DOS

IR

Vibrations