Geometry & MOs

Info

ID:	336792
PubChem CID:	127255799
Reduced:	BrClF2H4C7 (1)
Stoich.:	ABC2D4E7 (1)
Weight, g/mol:	195.965812
ΔH_f, kcal/mol:	-79.0
Dipole, Da:	2.49
IP(EA), eV:	-9.88(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chloro-4-(chloromethyl)-2,3-difluorobenzene

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1CBr)F)F)Cl

DOS

IR

Vibrations