Geometry & MOs

Info

ID:	53595
PubChem CID:	14716862
Reduced:	O2C15H22 (2)
Stoich.:	A2B15C22 (2)
Weight, g/mol:	442.235539
ΔH_f, kcal/mol:	-189.58
Dipole, Da:	2.47
IP(EA), eV:	-8.9(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-hexoxycarbonylphenyl) 4-(2-butoxyethoxy)benzoate

Drug info:

PubChemData

Smile

CCCCCCCCOC(C)COC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)CCCCCC

DOS

IR

Vibrations