Geometry & MOs

Info

ID:	264333
PubChem CID:	103454617
Reduced:	BrO3C8H11 (1)
Stoich.:	AB3C8D11 (1)
Weight, g/mol:	212.121258
ΔH_f, kcal/mol:	-110.23
Dipole, Da:	0.98
IP(EA), eV:	-9.57(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-fluorophenyl)hexane-2,3-diol

Drug info:

PubChemData

Smile

CCC(C(C1=C(C=CO1)Br)O)O

DOS

IR

Vibrations