Geometry & MOs

Info

ID:	283551
PubChem CID:	103988281
Reduced:	ClFNO2H13C15 (1)
Stoich.:	ABCD2E13F15 (1)
Weight, g/mol:	235.137242
ΔH_f, kcal/mol:	-93.56
Dipole, Da:	1.9
IP(EA), eV:	-9.09(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-fluoro-3-methylphenoxy)-2,2-dimethylpentanenitrile

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)OCC(=O)NC2=CC=CC=C2Cl)F

DOS

IR

Vibrations