Geometry & MOs

Info

ID:	436737
PubChem CID:	135208805
Reduced:	OH24C42 (1)
Stoich.:	AB24C42 (1)
Weight, g/mol:	248.125988
ΔH_f, kcal/mol:	144.69
Dipole, Da:	1.56
IP(EA), eV:	-8.33(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[2-(carboxymethoxy)ethoxy]-5-methylhexanoic acid

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2C4=C5C=CC6=CC=CC7=C6C5=C(C=C7)C=C4)C8=C9C1=CC=CC=C1OC9=CC=C8

DOS

IR

Vibrations