Geometry & MOs

Info

ID:	130655
PubChem CID:	51091906
Reduced:	ON4C20H28 (1)
Stoich.:	AB4C20D28 (1)
Weight, g/mol:	295.168462
ΔH_f, kcal/mol:	-11.1
Dipole, Da:	5.27
IP(EA), eV:	-8.81(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1-phenylethyl)pyrrolidin-3-yl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)CC(=O)NC2CCN(C2)C(C)C3=CC=CC=C3

DOS

IR

Vibrations