Geometry & MOs

Info

ID:	303109
PubChem CID:	124489219
Reduced:	BrCl2C9H9 (1)
Stoich.:	AB2C9D9 (1)
Weight, g/mol:	305.88255
ΔH_f, kcal/mol:	-11.66
Dipole, Da:	2.12
IP(EA), eV:	-9.68(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1S)-1-bromo-2,2,2-trifluoroethyl]-2,4-dichlorobenzene

Drug info:

PubChemData

Smile

CC[C@H](C1=C(C=C(C=C1)Cl)Cl)Br

DOS

IR

Vibrations