Geometry & MOs

Info

ID:

370544

PubChem CID:

127339625

Reduced:

SN3O5C16H25 (1)

Stoich.:

AB3C5D16E25 (1)

Weight, g/mol:

237.049336

ΔHf, kcal/mol:

-236.08

Dipole, Da:

5.64

IP(EA), eV:

-10.2(-0.04)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-2-methylsulfanylethanone

Drug info:

PubChemData

Smile

CC1CCCCC12C(=O)N(C(=O)N2)CC(=O)N3CCS(=O)(=O)C(C3)C

DOS

IR

Vibrations