Geometry & MOs

Info

ID:	349897
PubChem CID:	127276702
Reduced:	SN3O3C15H19 (1)
Stoich.:	AB3C3D15E19 (1)
Weight, g/mol:	333.078327
ΔH_f, kcal/mol:	-69.16
Dipole, Da:	8.16
IP(EA), eV:	-9.11(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]-1H-[1]benzofuro[3,2-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

C1CN(N=C1C2=CC=CC=C2)C(=O)CN3CCS(=O)(=O)CC3

DOS

IR

Vibrations