Geometry & MOs

Info

ID:	263530
PubChem CID:	103375810
Reduced:	NO2C12H15 (1)
Stoich.:	AB2C12D15 (1)
Weight, g/mol:	195.069557
ΔH_f, kcal/mol:	-43.53
Dipole, Da:	3.28
IP(EA), eV:	-9.76(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-fluorophenyl)-2-(2-hydroxyethoxy)acetonitrile

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1C(C#N)OCCO

DOS

IR

Vibrations