Geometry & MOs

Info

ID:	292869
PubChem CID:	117362155
Reduced:	F2O3C12H14 (1)
Stoich.:	A2B3C12D14 (1)
Weight, g/mol:	244.102334
ΔH_f, kcal/mol:	-212.16
Dipole, Da:	4.4
IP(EA), eV:	-9.08(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-difluoro-5-(piperazin-1-ylmethyl)benzene-1,3-diol

Drug info:

PubChemData

Smile

CC(CO)C1=CC2=C(C=C1C(C)(F)F)OCO2

DOS

IR

Vibrations