Geometry & MOs

Info

ID:	327495
PubChem CID:	126690111
Reduced:	O3H16C17 (1)
Stoich.:	A3B16C17 (1)
Weight, g/mol:	497.183164
ΔH_f, kcal/mol:	-92.37
Dipole, Da:	2.3
IP(EA), eV:	-9.78(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-ethyl-6-[4-(methylsulfanylamino)piperidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-4-(4-fluorophenyl)-N-methyl-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)CC(=O)O)C(=O)C2=CC=CC=C2C

DOS

IR

Vibrations