Geometry & MOs

Info

ID:	244469
PubChem CID:	99355653
Reduced:	ClO2N6H17C19 (1)
Stoich.:	AB2C6D17E19 (1)
Weight, g/mol:	397.130553
ΔH_f, kcal/mol:	21.98
Dipole, Da:	4.16
IP(EA), eV:	-8.95(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetamide

Drug info:

PubChemData

Smile

C1CN(CC(=O)N1)C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)N4C=NN=C4)Cl

DOS

IR

Vibrations