Geometry & MOs

Info

ID:	357196
PubChem CID:	127293700
Reduced:	ON6C17H24 (1)
Stoich.:	AB6C17D24 (1)
Weight, g/mol:	375.198048
ΔH_f, kcal/mol:	-13.38
Dipole, Da:	2.2
IP(EA), eV:	-9.18(-0.63)
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-(1-propan-2-ylpiperidin-4-yl)butanamide

Drug info:

PubChemData

Smile

C1CCC2CC(CCC2C1)NC(=O)CN3C=NC4=C(N=CN=C43)N

DOS

IR

Vibrations