Geometry & MOs

Info

ID:	396768
PubChem CID:	135029171
Reduced:	OH12C16 (1)
Stoich.:	AB12C16 (1)
Weight, g/mol:	372.193674
ΔH_f, kcal/mol:	107.2
Dipole, Da:	4.46
IP(EA), eV:	-9.04(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ditert-butyl 11-methylidene-3-oxospiro[5.5]undeca-1,4,9-triene-8,8-dicarboxylate

Drug info:

PubChemData

Smile

C=C1C=CC2=CC=CC=C2C13C=CC(=O)C=C3

DOS

IR

Vibrations