Geometry & MOs

Info

ID:	385569
PubChem CID:	134979428
Reduced:	OC8H14 (1)
Stoich.:	AB8C14 (1)
Weight, g/mol:	414.240624
ΔH_f, kcal/mol:	-62.98
Dipole, Da:	2.13
IP(EA), eV:	-9.84(2.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl (2E,4E,7R)-11-[(2R,3R)-3-(hydroxymethyl)-4-oxooxetan-2-yl]-3,5,7-trimethylundeca-2,4-dienoate

Drug info:

PubChemData

Smile

CC12CCC([C@@H]1O)CC2

DOS

IR

Vibrations