Geometry & MOs

Info

ID:	84243
PubChem CID:	49865095
Reduced:	ON6C21H26 (1)
Stoich.:	AB6C21D26 (1)
Weight, g/mol:	376.201159
ΔH_f, kcal/mol:	37.45
Dipole, Da:	6.83
IP(EA), eV:	-8.73(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)NC1=NN2C(=NC=C2C3=CC=C(C=C3)C(=O)NC[C@@H]4CCCN4)C=C1

DOS

IR

Vibrations