Geometry & MOs

Info

ID:	294708
PubChem CID:	117484275
Reduced:	OC10H14 (2)
Stoich.:	AB10C14 (2)
Weight, g/mol:	300.076451
ΔH_f, kcal/mol:	-109.92
Dipole, Da:	5.51
IP(EA), eV:	-9.42(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-chloro-2-hydroxy-5,6-dimethoxyphenyl)-3-cyclopropylpropanoic acid

Drug info:

PubChemData

Smile

CC1CCC(CC1)C2=CC=C(C=C2)C3(CCCCC3)C(=O)O

DOS

IR

Vibrations