Geometry & MOs

Info

ID:	205868
PubChem CID:	80167675
Reduced:	FN2O3C13H17 (1)
Stoich.:	AB2C3D13E17 (1)
Weight, g/mol:	269.11757
ΔH_f, kcal/mol:	-83.95
Dipole, Da:	7.12
IP(EA), eV:	-9.64(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-[(3-fluoro-4-nitrophenyl)methylamino]propanamide

Drug info:

PubChemData

Smile

C1CCC(C1)(COCC2=CC(=C(C=C2)[N+](=O)[O-])F)N

DOS

IR

Vibrations