Geometry & MOs

Info

ID:	140302
PubChem CID:	52679043
Reduced:	FN2O2C17H19 (1)
Stoich.:	AB2C2D17E19 (1)
Weight, g/mol:	302.143056
ΔH_f, kcal/mol:	-16.66
Dipole, Da:	7.39
IP(EA), eV:	-9.22(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(4-fluorophenyl)-N-methyl-N-[2-(4-nitrophenyl)ethyl]ethanamine

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=C(C=C1)F)N(C)CCC2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations