Geometry & MOs

Info

ID:	359668
PubChem CID:	127299050
Reduced:	N2S2O5C15H20 (1)
Stoich.:	A2B2C5D15E20 (1)
Weight, g/mol:	342.136176
ΔH_f, kcal/mol:	-196.44
Dipole, Da:	5.86
IP(EA), eV:	-9.64(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1,1-dioxo-1,4-thiazinan-4-yl)-1-oxopropan-2-yl]-3-(4-methylpyrazol-1-yl)propanamide

Drug info:

PubChemData

Smile

CC(C(=O)N1CCS(=O)(=O)CC1)NC(=O)C2=CC3=C(S2)CCOC3

DOS

IR

Vibrations