Geometry & MOs

Info

ID:	303111
PubChem CID:	124489221
Reduced:	BrCl2F3H4C8 (1)
Stoich.:	AB2C3D4E8 (1)
Weight, g/mol:	254.06701
ΔH_f, kcal/mol:	-156.36
Dipole, Da:	1.68
IP(EA), eV:	-10.04(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R)-1-bromoheptyl]benzene

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)Cl)[C@H](C(F)(F)F)Br

DOS

IR

Vibrations