Geometry & MOs

Info

ID:	246152
PubChem CID:	103047051
Reduced:	FNCl2O3H10C14 (1)
Stoich.:	ABC2D3E10F14 (1)
Weight, g/mol:	395.88864
ΔH_f, kcal/mol:	-67.41
Dipole, Da:	6.47
IP(EA), eV:	-9.97(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(bromomethyl)-3,5-dichloro-2-[(5-chloro-2-fluorophenyl)methoxy]benzene

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1[N+](=O)[O-])CCl)OCC2=C(C=CC(=C2)Cl)F

DOS

IR

Vibrations