Geometry & MOs

Info

ID:	183865
PubChem CID:	77083038
Reduced:	SO2N3C11H19 (1)
Stoich.:	AB2C3D11E19 (1)
Weight, g/mol:	318.103814
ΔH_f, kcal/mol:	-64.37
Dipole, Da:	5.49
IP(EA), eV:	-8.82(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,1-dioxo-1,4-thiazinan-4-yl)-(1-methyl-5-phenylpyrrol-2-yl)methanone

Drug info:

PubChemData

Smile

CN1C(=CC=N1)CCNC(=O)C(CCSC)O

DOS

IR

Vibrations