Geometry & MOs

Info

ID:	312737
PubChem CID:	126607657
Reduced:	FO3N4C18H19 (1)
Stoich.:	AB3C4D18E19 (1)
Weight, g/mol:	487.224435
ΔH_f, kcal/mol:	-80.11
Dipole, Da:	4.38
IP(EA), eV:	-8.35(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[3-(4-fluorophenyl)-1-methyl-5-[4-(1,2-oxazol-3-ylmethyl)piperazin-1-yl]pyrazol-4-yl]-N-methylimidazo[1,2-b]pyridazin-2-amine

Drug info:

PubChemData

Smile

CC1C2C3=C(N=C1OC/C=C/COC4=C(C=CC(=C4)CN2C(=O)N3)F)N

DOS

IR

Vibrations