Geometry & MOs

Info

ID:	287285
PubChem CID:	104234255
Reduced:	FN2O2C15H21 (1)
Stoich.:	AB2C2D15E21 (1)
Weight, g/mol:	284.132491
ΔH_f, kcal/mol:	-100.96
Dipole, Da:	3.98
IP(EA), eV:	-9.01(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-fluoro-4-[1-(methylamino)ethyl]phenoxy]methyl]benzonitrile

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)OC(C)C(=O)NCC=C)F)NC

DOS

IR

Vibrations