Geometry & MOs

Info

ID:	444646
PubChem CID:	135263121
Reduced:	SN3O4C13H17 (1)
Stoich.:	AB3C4D13E17 (1)
Weight, g/mol:	270.067428
ΔH_f, kcal/mol:	-111.28
Dipole, Da:	6.63
IP(EA), eV:	-9.43(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-(1,1-dioxo-1,4-thiazinan-4-yl)pyridin-2-yl]acetic acid

Drug info:

PubChemData

Smile

COC(=O)C1(CC1)C2=CN=C(N=C2)N3CCS(=O)(=O)CC3

DOS

IR

Vibrations