Geometry & MOs

Info

ID:	293152
PubChem CID:	117375124
Reduced:	BrFO2C9H10 (1)
Stoich.:	ABC2D9E10 (1)
Weight, g/mol:	247.98482
ΔH_f, kcal/mol:	-114.98
Dipole, Da:	3.93
IP(EA), eV:	-9.22(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1CCO)Br)F

DOS

IR

Vibrations