Geometry & MOs

Info

ID:	312711
PubChem CID:	126607547
Reduced:	NOC5H6 (4)
Stoich.:	ABC5D6 (4)
Weight, g/mol:	466.112043
ΔH_f, kcal/mol:	-4.29
Dipole, Da:	6.16
IP(EA), eV:	-8.84(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-[(E)-1-amino-1-(4-fluorophenyl)-3-methyliminoprop-1-en-2-yl]imidazo[1,2-b]pyridazin-2-yl]-5-chloro-2-fluorobenzamide

Drug info:

PubChemData

Smile

CN(CC1=CC(=CC=C1)OCCC=C)C2=CC(=NC(=C2[N+](=O)[O-])N)OCC=C

DOS

IR

Vibrations