Geometry & MOs

Info

ID:	140282
PubChem CID:	52675096
Reduced:	ON4C21H38 (1)
Stoich.:	AB4C21D38 (1)
Weight, g/mol:	374.18147
ΔH_f, kcal/mol:	-34.15
Dipole, Da:	4.83
IP(EA), eV:	-8.32(0.35)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

6-(4-fluorophenyl)-N-[1-(2-methylpropyl)piperidin-1-ium-4-yl]imidazo[2,1-b][1,3,4]thiadiazol-2-amine

Drug info:

PubChemData

Smile

CC[NH+](CC)CC(=O)NCCCC[NH+]1CCN(CC1)CC2=CC=CC=C2

DOS

IR

Vibrations