Geometry & MOs

Info

ID:	235676
PubChem CID:	92710394
Reduced:	ON5C22H29 (1)
Stoich.:	AB5C22D29 (1)
Weight, g/mol:	426.049019
ΔH_f, kcal/mol:	0.03
Dipole, Da:	5.27
IP(EA), eV:	-9.42(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2R)-6-(dimethylsulfamoyl)-4-methyl-3-oxo-1,4-benzothiazin-2-yl]-N-(1,3-thiazol-2-yl)acetamide

Drug info:

PubChemData

Smile

CC(C)[C@H](C1=NC2=C(N1C(C)C)N=CC=C2)NC(=O)NCCC3=CC=CC=C3

DOS

IR

Vibrations