Geometry & MOs

Info

ID:	294977
PubChem CID:	117510276
Reduced:	FO3C20H21 (1)
Stoich.:	AB3C20D21 (1)
Weight, g/mol:	328.167459
ΔH_f, kcal/mol:	-121.23
Dipole, Da:	4.29
IP(EA), eV:	-9.07(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-ethoxy-2-phenylmethoxyphenyl)-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1OCC2=CC=CC=C2)F)C(CC(=O)O)C3CC3

DOS

IR

Vibrations