Geometry & MOs

Info

ID:	131520
PubChem CID:	51220159
Reduced:	ClN3O3C18H18 (1)
Stoich.:	AB3C3D18E18 (1)
Weight, g/mol:	369.114713
ΔH_f, kcal/mol:	-95.87
Dipole, Da:	9.13
IP(EA), eV:	-9.01(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-3-[[2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetyl]amino]benzamide

Drug info:

PubChemData

Smile

CCNC(=O)C1=CC(=CC=C1)NC(=O)CNC(=O)C2=CC=CC=C2Cl

DOS

IR

Vibrations