Geometry & MOs

Info

ID:	196646
PubChem CID:	78857911
Reduced:	SF3O4N5C14H14 (1)
Stoich.:	AB3C4D5E14F14 (1)
Weight, g/mol:	409.236542
ΔH_f, kcal/mol:	-173.84
Dipole, Da:	12.47
IP(EA), eV:	-9.96(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-methylphenoxy)ethyl]-2-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methylamino]propanamide

Drug info:

PubChemData

Smile

C1CC2=NN=C(N2C1)CCNC3=C(C=C(C=C3)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

DOS

IR

Vibrations