Geometry & MOs

Info

ID:	208322
PubChem CID:	80519333
Reduced:	SN2O5C12H22 (1)
Stoich.:	AB2C5D12E22 (1)
Weight, g/mol:	279.0599
ΔH_f, kcal/mol:	-245.0
Dipole, Da:	7.26
IP(EA), eV:	-10.24(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(C)NC(=O)CN1CCS(=O)(=O)CC1CC(=O)O

DOS

IR

Vibrations