Geometry & MOs

Info

ID:	122884
PubChem CID:	50825430
Reduced:	OSN7C25H35 (1)
Stoich.:	ABC7D25E35 (1)
Weight, g/mol:	495.27803
ΔH_f, kcal/mol:	31.37
Dipole, Da:	4.93
IP(EA), eV:	-8.1(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[5-(cyclopentylamino)-6-(4-ethylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]-N-(2-methylpropyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCCNC(=O)N1CCN(CC1)C2=NN3C(=C(N=C3S2)C4=CC=C(C=C4)CC)NC5CCCC5

DOS

IR

Vibrations