Geometry & MOs

Info

ID:	220307
PubChem CID:	85177280
Reduced:	O3C15H16 (1)
Stoich.:	A3B15C16 (1)
Weight, g/mol:	244.109944
ΔH_f, kcal/mol:	-84.76
Dipole, Da:	1.88
IP(EA), eV:	-9.03(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-3-methyl-2-naphthalen-2-ylbutanoic acid

Drug info:

PubChemData

Smile

CCC1=CC=CC2=C1OC(=C2)C=CC(=O)OCC

DOS

IR

Vibrations