Geometry & MOs

Info

ID:	65313
PubChem CID:	29212050
Reduced:	ON6C18H22 (1)
Stoich.:	AB6C18D22 (1)
Weight, g/mol:	417.241627
ΔH_f, kcal/mol:	73.32
Dipole, Da:	6.58
IP(EA), eV:	-9.29(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,4S)-1-benzyl-N-ethyl-4-[(4-methoxynaphthalen-1-yl)methylamino]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C[C@@]1\2CC[C@@H](C1(C)C)C/C2=N\NC(=O)C3=CC=C(C=C3)C4=NNN=N4

DOS

IR

Vibrations