Geometry & MOs

Info

ID:	269798
PubChem CID:	103619062
Reduced:	FN3O3H10C13 (1)
Stoich.:	AB3C3D10E13 (1)
Weight, g/mol:	295.13322
ΔH_f, kcal/mol:	-48.75
Dipole, Da:	5.0
IP(EA), eV:	-9.27(-1.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-amino-5-fluoro-3-nitrophenyl)-(3,5-dimethylpiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations