Geometry & MOs

Info

ID:	28001
PubChem CID:	824751
Reduced:	ON3C22H23 (1)
Stoich.:	AB3C22D23 (1)
Weight, g/mol:	242.094294
ΔH_f, kcal/mol:	10.59
Dipole, Da:	7.55
IP(EA), eV:	-8.61(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3R)-3-hydroxy-2,3-diphenylpropanoic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)C(=C2C3=CC=CC=C3CC(N2)(C)C)C#N)C

DOS

IR

Vibrations