Geometry & MOs

Info

ID:	84192
PubChem CID:	49864900
Reduced:	O2N5C28H33 (1)
Stoich.:	A2B5C28D33 (1)
Weight, g/mol:	570.170165
ΔH_f, kcal/mol:	-25.02
Dipole, Da:	7.28
IP(EA), eV:	-7.96(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3S)-1-benzylpyrrolidin-3-yl]-4-[6-[(3,4-dichlorophenyl)methylamino]imidazo[1,2-b]pyridazin-3-yl]benzamide

Drug info:

PubChemData

Smile

CN1C=C(C2=CC=CC=C21)CN3CCC(CC3)C(=O)N4CCC(CC4)N5C6=CC=CC=C6NC5=O

DOS

IR

Vibrations