Geometry & MOs

Info

ID:	52760
PubChem CID:	12015875
Reduced:	OC8H13 (2)
Stoich.:	AB8C13 (2)
Weight, g/mol:	246.125594
ΔH_f, kcal/mol:	-108.31
Dipole, Da:	3.31
IP(EA), eV:	-8.57(1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S)-2-cyclohex-2-en-1-yl-2-hydroxy-2-phenylacetate

Drug info:

PubChemData

Smile

CC(=CCO/C=C/1\CCC[C@@]2([C@@H]1CCCC2)O)C

DOS

IR

Vibrations