Geometry & MOs

Info

ID:	179587
PubChem CID:	76505759
Reduced:	SSi2O6C33H58 (1)
Stoich.:	AB2C6D33E58 (1)
Weight, g/mol:	440.183503
ΔH_f, kcal/mol:	-392.1
Dipole, Da:	5.36
IP(EA), eV:	-9.03(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-benzoyloxy-2-(4-phenoxypentanoyl)cyclopentyl]-2-hydroxyacetic acid

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)OC(CC=C(C)C)C(C)CCCC2(C(CCC(=CCO[Si](C)(C)C)CO2)O[Si](C)(C)C)C

DOS

IR

Vibrations