Geometry & MOs

Info

ID:	352331
PubChem CID:	127283415
Reduced:	SN3O5C17H27 (1)
Stoich.:	AB3C5D17E27 (1)
Weight, g/mol:	342.136176
ΔH_f, kcal/mol:	-237.96
Dipole, Da:	1.85
IP(EA), eV:	-9.54(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dimethylpyrazol-1-yl)-N-[1-(1,1-dioxo-1,4-thiazinan-4-yl)-1-oxopropan-2-yl]acetamide

Drug info:

PubChemData

Smile

CC(C(=O)N1CCS(=O)(=O)CC1)NC(=O)C2CC(=O)N(C2)C3CCCC3

DOS

IR

Vibrations