Geometry & MOs

Info

ID:	386502
PubChem CID:	134981954
Reduced:	O2H10C11 (2)
Stoich.:	A2B10C11 (2)
Weight, g/mol:	232.109944
ΔH_f, kcal/mol:	-87.37
Dipole, Da:	1.5
IP(EA), eV:	-8.04(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-hydroxy-3-propan-2-yl-1H-indene-2-carboxylate

Drug info:

PubChemData

Smile

CC(=O)OC1=CC2=CC=C3C=C(C=C4C3(C2(C(=C1)C=C4)C)C)OC(=O)C

DOS

IR

Vibrations