Geometry & MOs

Info

ID:	261806
PubChem CID:	103252287
Reduced:	ClSN3O3C12H12 (1)
Stoich.:	ABC3D3E12F12 (1)
Weight, g/mol:	283.018225
ΔH_f, kcal/mol:	-63.06
Dipole, Da:	4.86
IP(EA), eV:	-8.65(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-chloro-2,1,3-benzothiadiazol-4-yl)amino]cyclobutane-1-carboxylic acid

Drug info:

PubChemData

Smile

C1CC(OC1CNC2=C(C=CC3=NSN=C32)Cl)C(=O)O

DOS

IR

Vibrations