Geometry & MOs

Info

ID:	442125
PubChem CID:	135249959
Reduced:	FN6H17C22 (1)
Stoich.:	AB6C17D22 (1)
Weight, g/mol:	664.283826
ΔH_f, kcal/mol:	132.23
Dipole, Da:	3.9
IP(EA), eV:	-8.82(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-[7'-[5-(5,5-dimethyl-4H-1,3-oxazol-2-yl)pyridin-3-yl]-9,9'-spirobi[fluorene]-2'-yl]pyridin-3-yl]-5,5-dimethyl-4H-1,3-oxazole

Drug info:

PubChemData

Smile

C1CC(=CCC1C#N)C2=NC=CN3C2=C(C=N3)C4=CN(N=C4)C5=CC=C(C=C5)F

DOS

IR

Vibrations