Geometry & MOs

Info

ID:	357209
PubChem CID:	127293713
Reduced:	SO2N3C20H29 (1)
Stoich.:	AB2C3D20E29 (1)
Weight, g/mol:	375.161663
ΔH_f, kcal/mol:	-85.93
Dipole, Da:	3.32
IP(EA), eV:	-8.43(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,3-dihydro-1,4-benzothiazin-4-yl)-4-oxo-N-(2-oxo-2-piperidin-1-ylethyl)butanamide

Drug info:

PubChemData

Smile

CC(CN1CCCCC1)NC(=O)CCC(=O)N2CCSC3=CC=CC=C32

DOS

IR

Vibrations