Geometry & MOs

Info

ID:	201366
PubChem CID:	79528194
Reduced:	ClSN2C12H15 (1)
Stoich.:	ABC2D12E15 (1)
Weight, g/mol:	281.98263
ΔH_f, kcal/mol:	16.79
Dipole, Da:	0.44
IP(EA), eV:	-9.44(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-N-cyclobutyl-1,3-benzothiazol-2-amine

Drug info:

PubChemData

Smile

CCC(C)C(C1=NC2=C(S1)C=C(C=C2)Cl)N

DOS

IR

Vibrations