Geometry & MOs

Info

ID:	84240
PubChem CID:	49865092
Reduced:	OCl2N5H15C20 (1)
Stoich.:	AB2C5D15E20 (1)
Weight, g/mol:	336.169859
ΔH_f, kcal/mol:	70.18
Dipole, Da:	3.54
IP(EA), eV:	-9.01(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(6-aminoimidazo[1,2-b]pyridazin-3-yl)-N-[[(2S)-pyrrolidin-2-yl]methyl]benzamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2=CN=C3N2N=C(C=C3)NCC4=CC(=C(C=C4)Cl)Cl)C(=O)N

DOS

IR

Vibrations