Geometry & MOs

Info

ID:	227844
PubChem CID:	87562684
Reduced:	N2O3C18H30 (1)
Stoich.:	A2B3C18D30 (1)
Weight, g/mol:	473.977736
ΔH_f, kcal/mol:	-110.94
Dipole, Da:	4.06
IP(EA), eV:	-9.82(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2,2,2-trifluoroacetamide;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate

Drug info:

PubChemData

Smile

COC(=O)CCCCCCCCC/C=C\CCC/C(=C/[N+]#N)/[O-]

DOS

IR

Vibrations