Geometry & MOs

Info

ID:	131709
PubChem CID:	51248645
Reduced:	NO2C10H13 (2)
Stoich.:	AB2C10D13 (2)
Weight, g/mol:	390.080491
ΔH_f, kcal/mol:	-127.52
Dipole, Da:	3.54
IP(EA), eV:	-8.34(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-chloro-3-oxo-4H-1,4-benzothiazin-2-yl)-N-[2-(4-methoxyphenyl)ethyl]acetamide

Drug info:

PubChemData

Smile

CCOC1=CC(=C(C=C1)OCC)NC(C)C(=O)NC2=CC=CC=C2OC

DOS

IR

Vibrations