Geometry & MOs

Info

ID:

370827

PubChem CID:

127340963

Reduced:

N2S2O3C14H18 (1)

Stoich.:

A2B2C3D14E18 (1)

Weight, g/mol:

233.14495

ΔHf, kcal/mol:

-68.74

Dipole, Da:

6.35

IP(EA), eV:

-9.0(-0.83)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-(3,3-dimethylbutyl)-2-methyl-1,4-thiazinane 1,1-dioxide

Drug info:

PubChemData

Smile

CC1CN(CCS1(=O)=O)CC2=C(OC(=N2)C3=CSC=C3)C

DOS

IR

Vibrations