Geometry & MOs

Info

ID:	162906
PubChem CID:	57580747
Reduced:	SO3N5H21C22 (1)
Stoich.:	AB3C5D21E22 (1)
Weight, g/mol:	491.206973
ΔH_f, kcal/mol:	-18.59
Dipole, Da:	6.77
IP(EA), eV:	-8.39(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[8-[4-(4-pyridin-2-ylpiperazine-1-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one

Drug info:

PubChemData

Smile

C1CS(=O)(=O)CCN1C2=CC=C(C=C2)NC3=CC=C(N4C3=NC=C4)C5=CC(=O)NC=C5

DOS

IR

Vibrations