Geometry & MOs

Info

ID:	399221
PubChem CID:	135038849
Reduced:	SN3C8H19 (1)
Stoich.:	AB3C8D19 (1)
Weight, g/mol:	210.046299
ΔH_f, kcal/mol:	0.0
Dipole, Da:	5.44
IP(EA), eV:	-8.56(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3,4-dimethyl-1,3-dihydrothieno[3,2-e][1,4]diazepine-2,5-dione

Drug info:

PubChemData

Smile

CNCCC[NH+]=C(CCC[S-])N

DOS

IR

Vibrations