Geometry & MOs

Info

ID:	259838
PubChem CID:	103175927
Reduced:	O5C12H22 (1)
Stoich.:	A5B12C22 (1)
Weight, g/mol:	268.131074
ΔH_f, kcal/mol:	-214.9
Dipole, Da:	7.63
IP(EA), eV:	-10.05(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(3-methoxypropoxy)ethoxymethyl]benzoic acid

Drug info:

PubChemData

Smile

COCCCOCCOCC1(CC1)CC(=O)O

DOS

IR

Vibrations