Geometry & MOs

Info

ID:	370825
PubChem CID:	127340961
Reduced:	SO2N4C12H20 (1)
Stoich.:	AB2C4D12E20 (1)
Weight, g/mol:	284.130697
ΔH_f, kcal/mol:	-27.62
Dipole, Da:	9.15
IP(EA), eV:	-9.6(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-4-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)-1,4-thiazinane 1,1-dioxide

Drug info:

PubChemData

Smile

CC1CN(CCS1(=O)=O)CC2=NN=C(N2C3CC3)C

DOS

IR

Vibrations