Geometry & MOs

Info

ID:	263737
PubChem CID:	103394012
Reduced:	ClFNC11H11 (1)
Stoich.:	ABCD11E11 (1)
Weight, g/mol:	401.90893
ΔH_f, kcal/mol:	-16.58
Dipole, Da:	0.95
IP(EA), eV:	-9.39(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromo-4-fluoro-2-methoxyphenyl)-2-(4-bromophenyl)ethanone

Drug info:

PubChemData

Smile

C1C(CC1=CC2=C(C=CC(=C2)Cl)F)N

DOS

IR

Vibrations