Geometry & MOs

Info

ID:	392542
PubChem CID:	135017124
Reduced:	FC6H6 (2)
Stoich.:	AB6C6 (2)
Weight, g/mol:	412.142307
ΔH_f, kcal/mol:	-86.17
Dipole, Da:	2.03
IP(EA), eV:	-9.01(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[3-(2-acetyloxyphenyl)-6-methylquinoxalin-2-yl]phenyl] acetate

Drug info:

PubChemData

Smile

C/C=C\1/C2=CC=CC=C2CCC1(F)F

DOS

IR

Vibrations