Geometry & MOs

Info

ID:	370532
PubChem CID:	127339545
Reduced:	S2N3O5C13H19 (1)
Stoich.:	A2B3C5D13E19 (1)
Weight, g/mol:	256.088164
ΔH_f, kcal/mol:	-169.81
Dipole, Da:	3.22
IP(EA), eV:	-10.2(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-(4-methyl-1H-pyrrol-3-yl)methanone

Drug info:

PubChemData

Smile

CC1CN(CCS1(=O)=O)C(=O)CN(C)S(=O)(=O)C2=CN=CC=C2

DOS

IR

Vibrations