Geometry & MOs

Info

ID:	205875
PubChem CID:	80169854
Reduced:	N3O3C14H17 (1)
Stoich.:	A3B3C14D17 (1)
Weight, g/mol:	261.080121
ΔH_f, kcal/mol:	2.84
Dipole, Da:	7.56
IP(EA), eV:	-8.83(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-4-[(4-methylphenoxy)methyl]-1-nitrobenzene

Drug info:

PubChemData

Smile

CNC1=C(C=CC(=C1)CN(C)CC2=COC=C2)[N+](=O)[O-]

DOS

IR

Vibrations