Geometry & MOs

Info

ID:	372483
PubChem CID:	131298399
Reduced:	BrOCl2F3H4C8 (1)
Stoich.:	ABC2D3E4F8 (1)
Weight, g/mol:	214.07537
ΔH_f, kcal/mol:	-197.01
Dipole, Da:	2.38
IP(EA), eV:	-9.93(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-aminopropyl)-2-fluoro-6-nitrophenol

Drug info:

PubChemData

Smile

C1=C(C(=CC(=C1OC(F)(F)F)Br)Cl)CCl

DOS

IR

Vibrations