Geometry & MOs

Info

ID:	221802
PubChem CID:	85286158
Reduced:	O7C39H44 (1)
Stoich.:	A7B39C44 (1)
Weight, g/mol:	624.257701
ΔH_f, kcal/mol:	-160.79
Dipole, Da:	5.28
IP(EA), eV:	-8.88(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[8-[tert-butyl(diphenyl)silyl]oxy-2-hydroxy-2,6-dimethyl-1-methylsulfonyloxyoct-6-en-3-yl] benzoate

Drug info:

PubChemData

Smile

COC1C(C(C(C(C1OCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC=C)OCC5=CC=C(C=C5)OC

DOS

IR

Vibrations