Geometry & MOs

Info

ID:	306340
PubChem CID:	125003836
Reduced:	N3O3C24H29 (1)
Stoich.:	A3B3C24D29 (1)
Weight, g/mol:	407.220892
ΔH_f, kcal/mol:	-75.61
Dipole, Da:	4.83
IP(EA), eV:	-9.16(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-(4-benzyloxane-4-carbonyl)-N-methyl-2-pyridin-2-ylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)[C@]1(CCCN1C(=O)C2(CCOCC2)CC3=CC=CC=C3)C4=CC=CC=N4

DOS

IR

Vibrations