Geometry & MOs

Info

ID:	803
PubChem CID:	3374
Reduced:	FNO3H12C14 (1)
Stoich.:	ABC3D12E14 (1)
Weight, g/mol:	261.080121
ΔH_f, kcal/mol:	-153.16
Dipole, Da:	11.05
IP(EA), eV:	-9.4(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-fluoro-12-methyl-4-oxo-1-azatricyclo[7.3.1.05,13]trideca-2,5,7,9(13)-tetraene-3-carboxylic acid

Drug info:

PubChemData

Smile

CC1CCC2=C3N1C=C(C(=O)C3=CC(=C2)F)C(=O)O

DOS

IR

Vibrations