Geometry & MOs

Info

ID:	122255
PubChem CID:	50799898
Reduced:	ClS2O3N4H23C26 (1)
Stoich.:	AB2C3D4E23F26 (1)
Weight, g/mol:	398.016177
ΔH_f, kcal/mol:	-56.28
Dipole, Da:	5.11
IP(EA), eV:	-8.93(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-(3-ethyl-2-oxo-1,3-benzothiazol-6-yl)-2-methoxybenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)NC4=CC=CC=C4Cl)SC5=C3CCN(C5)C(=O)C

DOS

IR

Vibrations