Geometry & MOs

Info

ID:	333600
PubChem CID:	127252152
Reduced:	FN3O3H22C23 (1)
Stoich.:	AB3C3D22E23 (1)
Weight, g/mol:	343.189592
ΔH_f, kcal/mol:	-65.51
Dipole, Da:	4.5
IP(EA), eV:	-9.7(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methoxyethyl)-N-methyl-3-[(3-phenyl-1,2-oxazol-5-yl)methyl]pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1(CCN(C1)C(=O)C2=CC=C(C=C2)F)CC3=CC(=NO3)C4=CC=CC=C4

DOS

IR

Vibrations