Geometry & MOs

Info

ID:	219729
PubChem CID:	85164696
Reduced:	O3C39H58 (1)
Stoich.:	A3B39C58 (1)
Weight, g/mol:	574.384222
ΔH_f, kcal/mol:	-199.48
Dipole, Da:	2.84
IP(EA), eV:	-8.96(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[5-[tert-butyl(diphenyl)silyl]oxypentyl]-3-(1-hydroxyoct-2-enyl)-1,2,3,3a,4,6a-hexahydropentalen-2-ol

Drug info:

PubChemData

Smile

CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC(=O)CCC6=CC=C(C=C6)O)C)C)C2C1)C)C)C

DOS

IR

Vibrations