Geometry & MOs

Info

ID:	294503
PubChem CID:	117465059
Reduced:	BrFNOC12H15 (1)
Stoich.:	ABCDE12F15 (1)
Weight, g/mol:	287.0321
ΔH_f, kcal/mol:	-64.43
Dipole, Da:	1.25
IP(EA), eV:	-8.72(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1-aminocyclopentyl)-2-bromo-6-fluoro-3-methylphenol

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1C2CCCCN2)F)Br

DOS

IR

Vibrations