Geometry & MOs

Info

ID:	312730
PubChem CID:	126607599
Reduced:	NO4H17C20 (1)
Stoich.:	AB4C17D20 (1)
Weight, g/mol:	462.229186
ΔH_f, kcal/mol:	-89.16
Dipole, Da:	4.07
IP(EA), eV:	-8.57(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-[5-[1-(2-aminoethyl)piperidin-4-yl]-3-(4-fluorophenyl)-1-methylpyrazol-4-yl]imidazo[1,2-b]pyridazin-2-yl]formamide

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C=C(C1=O)C3=CC=C(C=C3)OCOC(=O)C=C

DOS

IR

Vibrations