Geometry & MOs

Info

ID:	218887
PubChem CID:	85090117
Reduced:	SSiO6C28H30 (1)
Stoich.:	ABC6D28E30 (1)
Weight, g/mol:	522.355654
ΔH_f, kcal/mol:	-201.72
Dipole, Da:	2.62
IP(EA), eV:	-9.1(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[3-(2,2-dimethylpropanoyloxy)-2-[3-(2,2-dimethylpropanoyloxy)oct-1-enyl]-5-hydroxycyclopentyl]hept-5-enoic acid

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)OCC3C(C(C(=O)O3)OC(=S)OC4=CC=CC=C4)O

DOS

IR

Vibrations