Geometry & MOs

Info

ID:	402135
PubChem CID:	135054569
Reduced:	OC11H22 (1)
Stoich.:	AB11C22 (1)
Weight, g/mol:	276.136159
ΔH_f, kcal/mol:	-96.15
Dipole, Da:	1.81
IP(EA), eV:	-10.02(2.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (4S)-4-ethenyl-2-hydroxy-4-methyl-2-phenyloxolane-3-carboxylate

Drug info:

PubChemData

Smile

CCC[C@@H]1CCC[C@]1(CCC)O

DOS

IR

Vibrations