Geometry & MOs

Info

ID:

324785

PubChem CID:

126678345

Reduced:

ON2H30C52 (1)

Stoich.:

AB2C30D52 (1)

Weight, g/mol:

344.072607

ΔHf, kcal/mol:

228.4

Dipole, Da:

2.23

IP(EA), eV:

 -8.05(-1.16)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

11-fluoro-N-hydroxy-12-methyl-6,12-dihydro-[3,1]benzazaphosphinino[2,3-c][1,4]benzoxazine-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)N3C4=C(C=CC5=C4C6=CC=CC=C6O5)C7=C3C8=C(C=C7)C9=CC=CC=C9N8C1=CC2=C(C=C1)C1=CC=CC3=C1C2=CC=C3

DOS

IR

Vibrations