Geometry & MOs

Info

ID:	138040
PubChem CID:	52302844
Reduced:	BrON3C19H22 (1)
Stoich.:	ABC3D19E22 (1)
Weight, g/mol:	364.215078
ΔH_f, kcal/mol:	9.7
Dipole, Da:	5.01
IP(EA), eV:	-8.97(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CN(CCN1CC2=CN=CC=C2)C(=O)CCC3=CC=CC=C3Br

DOS

IR

Vibrations