Geometry & MOs

Info

ID:	386903
PubChem CID:	134983332
Reduced:	OC8H9 (2)
Stoich.:	AB8C9 (2)
Weight, g/mol:	266.094294
ΔH_f, kcal/mol:	-67.78
Dipole, Da:	2.74
IP(EA), eV:	-9.44(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-methylphenyl)-7H-cyclopenta[f][1,3]benzodioxol-7-ol

Drug info:

PubChemData

Smile

C1C[C@@]2([C@@H](C1=O)CC=C2CCC3=CC=CC=C3)O

DOS

IR

Vibrations