Geometry & MOs

Info

ID:	57039
PubChem CID:	22395255
Reduced:	O3C37H58 (1)
Stoich.:	A3B37C58 (1)
Weight, g/mol:	361.27427
ΔH_f, kcal/mol:	-178.44
Dipole, Da:	4.53
IP(EA), eV:	-9.09(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

3-hexadecyl-2-hydroxybenzoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCC1=CC=CC=C1OC(=O)C2=CC=CC=C2OCCCCCCCCCCCC

DOS

IR

Vibrations