Geometry & MOs

Info

ID:	359695
PubChem CID:	127299077
Reduced:	S2N3O4C14H19 (1)
Stoich.:	A2B3C4D14E19 (1)
Weight, g/mol:	391.123563
ΔH_f, kcal/mol:	-143.54
Dipole, Da:	5.65
IP(EA), eV:	-9.5(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-butanoyl-N-[1-(1,1-dioxo-1,4-thiazinan-4-yl)-1-oxopropan-2-yl]-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)N1CCS(=O)(=O)CC1)NC(=O)CSC2=CC=NC=C2

DOS

IR

Vibrations