Geometry & MOs

Info

ID:	201852
PubChem CID:	79593366
Reduced:	BrFNC11H13 (1)
Stoich.:	ABCD11E13 (1)
Weight, g/mol:	357.97601
ΔH_f, kcal/mol:	-17.3
Dipole, Da:	3.39
IP(EA), eV:	-9.52(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromonaphthalen-1-yl)-2-(2-chlorophenyl)ethanone

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1CC=CCCN)Br)F

DOS

IR

Vibrations