Geometry & MOs

Info

ID:	359665
PubChem CID:	127299047
Reduced:	SN3O5C17H21 (1)
Stoich.:	AB3C5D17E21 (1)
Weight, g/mol:	387.182792
ΔH_f, kcal/mol:	-204.96
Dipole, Da:	2.07
IP(EA), eV:	-9.33(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations