Geometry & MOs

Info

ID:	54187
PubChem CID:	14747243
Reduced:	O2C14H17 (2)
Stoich.:	A2B14C17 (2)
Weight, g/mol:	552.41786
ΔH_f, kcal/mol:	-122.84
Dipole, Da:	1.12
IP(EA), eV:	-8.64(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,6-dibenzyl-13-dodecyl-1,4,8,11-tetraoxacyclotetradecane

Drug info:

PubChemData

Smile

C1COCCOCC(COCCOC1)(CC2=CC=CC=C2)CC3=CC=CC4=CC=CC=C43

DOS

IR

Vibrations