Geometry & MOs

Info

ID:	303083
PubChem CID:	124489188
Reduced:	FCl2H9C13 (1)
Stoich.:	AB2C9D13 (1)
Weight, g/mol:	254.006534
ΔH_f, kcal/mol:	-22.88
Dipole, Da:	2.72
IP(EA), eV:	-9.76(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chloro-3-[(S)-chloro-(4-fluorophenyl)methyl]benzene

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Cl)[C@@H](C2=CC=C(C=C2)F)Cl

DOS

IR

Vibrations