Geometry & MOs

Info

ID:	138041
PubChem CID:	52302995
Reduced:	N2O2C23H28 (1)
Stoich.:	A2B2C23D28 (1)
Weight, g/mol:	364.215078
ΔH_f, kcal/mol:	-68.56
Dipole, Da:	2.66
IP(EA), eV:	-9.29(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-(2-methylpropanoyl)-N-[(1S)-1-(4-phenylphenyl)ethyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=C(C=C1)C2=CC=CC=C2)NC(=O)[C@H]3CCCN3C(=O)C(C)C

DOS

IR

Vibrations