Geometry & MOs

Info

ID:	165831
PubChem CID:	74603325
Reduced:	O4C13H14 (1)
Stoich.:	A4B13C14 (1)
Weight, g/mol:	275.107205
ΔH_f, kcal/mol:	-132.36
Dipole, Da:	0.18
IP(EA), eV:	-8.42(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

3-(1-naphthalen-2-ylethyl)benzoate

Drug info:

PubChemData

Smile

CC(CC1=CC=C(C=C1)C(C)C(=O)[O-])C(=O)[O-]

DOS

IR

Vibrations