Geometry & MOs

Info

ID:	366184
PubChem CID:	127319593
Reduced:	S2N3O3C15H17 (1)
Stoich.:	A2B3C3D15E17 (1)
Weight, g/mol:	394.065714
ΔH_f, kcal/mol:	-75.39
Dipole, Da:	5.59
IP(EA), eV:	-9.64(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,2-dioxo-2lambda6-thia-3-azatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaen-3-yl)-N-(1,1-dioxothian-3-yl)acetamide

Drug info:

PubChemData

Smile

C1CC(CS(=O)(=O)C1)NC(=O)CC2=CSC(=N2)C3=CN=CC=C3

DOS

IR

Vibrations