Geometry & MOs

Info

ID:	13029
PubChem CID:	220046
Reduced:	O3C11H14 (1)
Stoich.:	A3B11C14 (1)
Weight, g/mol:	194.094294
ΔH_f, kcal/mol:	-127.0
Dipole, Da:	5.28
IP(EA), eV:	-9.26(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3,5-trimethylphenoxy)acetic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)OCC(=O)O)C)C

DOS

IR

Vibrations