Geometry & MOs

Info

ID:	122883
PubChem CID:	50825429
Reduced:	O2N4C25H28 (1)
Stoich.:	A2B4C25D28 (1)
Weight, g/mol:	481.26238
ΔH_f, kcal/mol:	-38.88
Dipole, Da:	5.2
IP(EA), eV:	-8.13(-0.51)
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-propylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)C)N3CCC(CC3)C(=O)NCC4=CC=CC=C4

DOS

IR

Vibrations