Geometry & MOs

Info

ID:	208323
PubChem CID:	80520332
Reduced:	NS2O4C10H17 (1)
Stoich.:	AB2C4D10E17 (1)
Weight, g/mol:	287.093977
ΔH_f, kcal/mol:	-183.25
Dipole, Da:	6.21
IP(EA), eV:	-9.04(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(2-methylpyrazol-3-yl)methyl]-1,1-dioxo-1,4-thiazinan-3-yl]acetic acid

Drug info:

PubChemData

Smile

C1CSCC1N2CCS(=O)(=O)CC2CC(=O)O

DOS

IR

Vibrations