Geometry & MOs

Info

ID:	297063
PubChem CID:	117607516
Reduced:	FNC7H8 (3)
Stoich.:	ABC7D8 (3)
Weight, g/mol:	414.166746
ΔH_f, kcal/mol:	-106.79
Dipole, Da:	6.87
IP(EA), eV:	-8.75(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-cyclopropylimidazo[1,2-b]pyridazin-2-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

C=C(C1=CNC2=C1CNCC2)N3CCC(CC3)C4=CC=CC=C4C(F)(F)F

DOS

IR

Vibrations