Geometry & MOs

Info

ID:	163696
PubChem CID:	58106716
Reduced:	FN3O3H30C46 (1)
Stoich.:	AB3C3D30E46 (1)
Weight, g/mol:	282.173213
ΔH_f, kcal/mol:	82.75
Dipole, Da:	1.7
IP(EA), eV:	-8.82(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC=C2C=C(C=CC2=C1)OC3=CC=CC(=N3)C(C4=NC(=CC=C4)OC5=CC6=CC=CC=C6C=C5)(C7=NC(=CC=C7)OC8=CC9=CC=CC=C9C=C8)F

DOS

IR

Vibrations