Geometry & MOs

Info

ID:	16912
PubChem CID:	479557
Reduced:	FN3O3H12C16 (1)
Stoich.:	AB3C3D12E16 (1)
Weight, g/mol:	313.086269
ΔH_f, kcal/mol:	-69.84
Dipole, Da:	6.32
IP(EA), eV:	-9.47(-2.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopropyl-7-fluoro-8-imidazol-1-yl-4-oxoquinolizine-3-carboxylic acid

Drug info:

PubChemData

Smile

C1CC1C2=C3C=C(C(=CN3C(=O)C(=C2)C(=O)O)F)N4C=CN=C4

DOS

IR

Vibrations