Geometry & MOs

Info

ID:	353609
PubChem CID:	127285186
Reduced:	N3O4C17H21 (1)
Stoich.:	A3B4C17D21 (1)
Weight, g/mol:	375.161663
ΔH_f, kcal/mol:	-154.59
Dipole, Da:	3.98
IP(EA), eV:	-9.28(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-acetylpiperidin-4-yl)methyl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide

Drug info:

PubChemData

Smile

CC(=O)N1CCC(CC1)CNC(=O)C2=CC3=C(C=C2)NC(=O)CO3

DOS

IR

Vibrations