Geometry & MOs

Info

ID:	302885
PubChem CID:	124398027
Reduced:	O3C12H16 (1)
Stoich.:	A3B12C16 (1)
Weight, g/mol:	208.109944
ΔH_f, kcal/mol:	-124.02
Dipole, Da:	2.32
IP(EA), eV:	-9.41(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S)-2-hydroxy-5-phenylpentanoate

Drug info:

PubChemData

Smile

COC(=O)[C@@H](CCCC1=CC=CC=C1)O

DOS

IR

Vibrations