Geometry & MOs

Info

ID:	264401
PubChem CID:	103459316
Reduced:	ClFO2H14C15 (1)
Stoich.:	ABC2D14E15 (1)
Weight, g/mol:	236.141244
ΔH_f, kcal/mol:	-107.7
Dipole, Da:	1.97
IP(EA), eV:	-9.54(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(oxolan-2-yl)-1-phenylbutane-1,2-diol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(C(CC2=C(C=C(C=C2)Cl)F)O)O

DOS

IR

Vibrations