Geometry & MOs

Info

ID:	20569
PubChem CID:	584635
Reduced:	OC5H6 (4)
Stoich.:	AB5C6 (4)
Weight, g/mol:	328.167459
ΔH_f, kcal/mol:	-135.08
Dipole, Da:	5.05
IP(EA), eV:	-8.5(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-hexoxyphenyl) 4-methoxybenzoate

Drug info:

PubChemData

Smile

CCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OC

DOS

IR

Vibrations