Geometry & MOs

Info

ID:	209341
PubChem CID:	80656006
Reduced:	ON6C13H22 (1)
Stoich.:	AB6C13D22 (1)
Weight, g/mol:	352.9656
ΔH_f, kcal/mol:	-3.92
Dipole, Da:	4.42
IP(EA), eV:	-9.09(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(5-bromo-1,3-benzothiazol-2-yl)propyl]-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)CN2CCN(C(=O)C2(C)C)C)NN

DOS

IR

Vibrations