Geometry & MOs

Info

ID:	357201
PubChem CID:	127293705
Reduced:	O2S2N3C19H21 (1)
Stoich.:	A2B2C3D19E21 (1)
Weight, g/mol:	361.182398
ΔH_f, kcal/mol:	-43.12
Dipole, Da:	2.01
IP(EA), eV:	-8.6(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,3-dihydro-1,4-benzothiazin-4-yl)-N-(1-ethylpiperidin-4-yl)-4-oxobutanamide

Drug info:

PubChemData

Smile

C1CCC2=C(C1)N=C(S2)NC(=O)CCC(=O)N3CCSC4=CC=CC=C43

DOS

IR

Vibrations