Geometry & MOs

Info

ID:	27523
PubChem CID:	821790
Reduced:	ON2Cl3C13H17 (1)
Stoich.:	AB2C3D13E17 (1)
Weight, g/mol:	254.13068
ΔH_f, kcal/mol:	-66.39
Dipole, Da:	4.16
IP(EA), eV:	-9.65(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3,5-diphenylpentanoic acid

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(=O)N[C@@H](C(Cl)(Cl)Cl)NC(C)C

DOS

IR

Vibrations