Geometry & MOs

Info

ID:	127314
PubChem CID:	50998141
Reduced:	FCl2O2H3C7 (1)
Stoich.:	AB2C2D3E7 (1)
Weight, g/mol:	239.9153
ΔH_f, kcal/mol:	-121.82
Dipole, Da:	4.96
IP(EA), eV:	-10.67(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-4-chloro-1,2-difluoro-5-methylbenzene

Drug info:

PubChemData

Smile

C1=C(C=C(C(=C1F)C(=O)O)Cl)Cl

DOS

IR

Vibrations