Geometry & MOs

Info

ID:	315883
PubChem CID:	126629260
Reduced:	ClSN2O2F3C21H22 (1)
Stoich.:	ABC2D2E3F21G22 (1)
Weight, g/mol:	488.134068
ΔH_f, kcal/mol:	-188.51
Dipole, Da:	2.77
IP(EA), eV:	-8.65(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2-piperidin-1-ylethoxy)-N-([1,3]thiazolo[5,4-e][1,3]benzothiazol-2-yl)naphthalene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1N=C(C2=CC=CC=C2Cl)N3CCOCC3)S(=O)CC(F)(F)F)C

DOS

IR

Vibrations