Geometry & MOs

Info

ID:	6560
PubChem CID:	68879
Reduced:	O4H14C17 (1)
Stoich.:	A4B14C17 (1)
Weight, g/mol:	282.089209
ΔH_f, kcal/mol:	-125.98
Dipole, Da:	7.27
IP(EA), eV:	-9.46(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-benzoyl-6-hydroxy-2,3-dihydro-1H-indene-1-carboxylic acid

Drug info:

PubChemData

Smile

C1CC2=CC(=C(C=C2C1C(=O)O)O)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations