Geometry & MOs

Info

ID:	232766
PubChem CID:	87576928
Reduced:	BrPF2O4C11H14 (1)
Stoich.:	ABC2D4E11F14 (1)
Weight, g/mol:	327.99603
ΔH_f, kcal/mol:	-325.55
Dipole, Da:	1.93
IP(EA), eV:	-9.28(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hydroxy-(2-methylphenoxy)-phenyl-lambda3-iodane

Drug info:

PubChemData

Smile

CCC(C)OP(=O)(C(C1=C(C=CC(=C1)O)Br)(F)F)O

DOS

IR

Vibrations