Geometry & MOs

Info

ID:	294230
PubChem CID:	117438608
Reduced:	O3C17H22 (1)
Stoich.:	A3B17C22 (1)
Weight, g/mol:	274.156895
ΔH_f, kcal/mol:	-114.63
Dipole, Da:	6.35
IP(EA), eV:	-8.86(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropyl]acetic acid

Drug info:

PubChemData

Smile

COC1=C(C2=C(CCCC2)C=C1)C(CC(=O)O)C3CC3

DOS

IR

Vibrations