Geometry & MOs

Info

ID:	161942
PubChem CID:	57393126
Reduced:	NO2C13H13 (2)
Stoich.:	AB2C13D13 (2)
Weight, g/mol:	430.189257
ΔH_f, kcal/mol:	-106.88
Dipole, Da:	2.8
IP(EA), eV:	-9.47(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-2-benzamidopropyl] (2R)-2-benzamido-3-phenylpropanoate

Drug info:

PubChemData

Smile

C[C@H](C(=O)OC[C@H](CC1=CC=CC=C1)NC(=O)C2=CC=CC=C2)NC(=O)C3=CC=CC=C3

DOS

IR

Vibrations