Geometry & MOs

Info

ID:	396105
PubChem CID:	135027388
Reduced:	OSC17H18 (1)
Stoich.:	ABC17D18 (1)
Weight, g/mol:	376.167459
ΔH_f, kcal/mol:	9.02
Dipole, Da:	4.22
IP(EA), eV:	-9.21(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-hydroxy-6-phenyl-4-(2-phenylmethoxyethyl)benzoate

Drug info:

PubChemData

Smile

CCCCC1=CC=C(S1)/C=C/C(=O)C2=CC=CC=C2

DOS

IR

Vibrations