Geometry & MOs

Info

ID:	413046
PubChem CID:	135085990
Reduced:	ClN2O2C11H11 (1)
Stoich.:	AB2C2D11E11 (1)
Weight, g/mol:	326.088338
ΔH_f, kcal/mol:	-16.84
Dipole, Da:	1.56
IP(EA), eV:	-8.84(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[tert-butyl-(4-fluorophenoxy)phosphoryl]oxy-4-fluorobenzene

Drug info:

PubChemData

Smile

CN1C2=C(C=C(C=C2)Cl)C=C1C(=O)NOC

DOS

IR

Vibrations