Geometry & MOs

Info

ID:	340890
PubChem CID:	127263325
Reduced:	BrFOH8C9 (1)
Stoich.:	ABCD8E9 (1)
Weight, g/mol:	227.99499
ΔH_f, kcal/mol:	-72.54
Dipole, Da:	4.78
IP(EA), eV:	-10.08(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(bromomethyl)-2-cyclopropyl-1-fluorobenzene

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)Br)C(=O)C)F

DOS

IR

Vibrations