Geometry & MOs

Info

ID:	54184
PubChem CID:	14747239
Reduced:	SO4C17H27 (2)
Stoich.:	AB4C17D27 (2)
Weight, g/mol:	652.216461
ΔH_f, kcal/mol:	-365.95
Dipole, Da:	1.67
IP(EA), eV:	-9.51(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2,2-dibenzyl-3-[2-(4-methylphenyl)sulfonyloxyethoxy]propoxy]ethyl 4-methylbenzenesulfonate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCC(C)(COCCOS(=O)(=O)C1=CC=C(C=C1)C)COCCOS(=O)(=O)C2=CC=C(C=C2)C

DOS

IR

Vibrations