Geometry & MOs

Info

ID:	442134
PubChem CID:	135250020
Reduced:	ON4H22C23 (1)
Stoich.:	AB4C22D23 (1)
Weight, g/mol:	712.308979
ΔH_f, kcal/mol:	100.6
Dipole, Da:	1.53
IP(EA), eV:	-8.42(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[3-[4-(5,5-dimethyl-4H-1,3-oxazol-2-yl)phenyl]spiro[benzo[a]fluorene-11,9'-fluorene]-9-yl]phenyl]-5,5-dimethyl-4H-1,3-oxazole

Drug info:

PubChemData

Smile

CCN1C=C(C=N1)C2=CC=C(C=C2)C3=C4C(=CC=CN4N=C3)C#CC(C)(C)O

DOS

IR

Vibrations