Geometry & MOs

Info

ID:	408097
PubChem CID:	135080853
Reduced:	ON2C12H16 (1)
Stoich.:	AB2C12D16 (1)
Weight, g/mol:	214.039672
ΔH_f, kcal/mol:	-14.32
Dipole, Da:	3.35
IP(EA), eV:	-9.36(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-4-(4-chlorophenyl)-2-hydroxybutanoic acid

Drug info:

PubChemData

Smile

C=CC[C@@](CC1=CC=CC=C1)(C(=O)N)N

DOS

IR

Vibrations