Geometry & MOs

Info

ID:	147401
PubChem CID:	53787057
Reduced:	OC18H26 (1)
Stoich.:	AB18C26 (1)
Weight, g/mol:	261.060135
ΔH_f, kcal/mol:	-41.72
Dipole, Da:	2.06
IP(EA), eV:	-9.21(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-fluoro-3-(4-fluorophenoxy)phenyl]-2-hydroxyacetonitrile

Drug info:

PubChemData

Smile

CCCC(C=CCC1=CC=CC=C1)C2CCCOC2

DOS

IR

Vibrations