Geometry & MOs

Info

ID:	48359
PubChem CID:	10539186
Reduced:	NF5C11H12 (1)
Stoich.:	AB5C11D12 (1)
Weight, g/mol:	259.084458
ΔH_f, kcal/mol:	-243.71
Dipole, Da:	4.08
IP(EA), eV:	-9.58(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3E)-3-[hydroxy(methoxy)methylidene]-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1)NCC(C(F)(F)F)(F)F

DOS

IR

Vibrations