Geometry & MOs

Info

ID:	50719
PubChem CID:	12013302
Reduced:	O3C16H16 (1)
Stoich.:	A3B16C16 (1)
Weight, g/mol:	270.125594
ΔH_f, kcal/mol:	-90.03
Dipole, Da:	7.05
IP(EA), eV:	-10.22(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4'-(2-methylprop-2-enyl)spiro[2-benzofuran-3,3'-cyclohexane]-1,1'-dione

Drug info:

PubChemData

Smile

C=CCC1CCC(=O)CC12C3=CC=CC=C3C(=O)O2

DOS

IR

Vibrations