Geometry & MOs

Info

ID:	45083
PubChem CID:	10507834
Reduced:	SiO6C36H46 (1)
Stoich.:	AB6C36D46 (1)
Weight, g/mol:	602.415522
ΔH_f, kcal/mol:	-267.68
Dipole, Da:	6.22
IP(EA), eV:	-9.06(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-5-[(1R,4Z,8E)-1-[tert-butyl(diphenyl)silyl]oxynonadeca-4,8-dienyl]oxolan-2-one

Drug info:

PubChemData

Smile

C[C@@H]1C[C@]2([C@@H](C=C1CO[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C(C)(C)C)/C=C/C(=O)OC)C(=O)O[C@@H](O2)C5CCCCC5

DOS

IR

Vibrations