Geometry & MOs

Info

ID:	355089
PubChem CID:	127288017
Reduced:	N3O4C19H25 (1)
Stoich.:	A3B4C19D25 (1)
Weight, g/mol:	344.184841
ΔH_f, kcal/mol:	-161.66
Dipole, Da:	2.73
IP(EA), eV:	-8.81(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[2-[[(2R)-5-oxopyrrolidine-2-carbonyl]amino]phenyl]methyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1CC(=O)N2CCC(CC2)NC(=O)[C@H]3CCC(=O)N3

DOS

IR

Vibrations