Geometry & MOs

Info

ID:	281325
PubChem CID:	103913706
Reduced:	FN2H11C16 (1)
Stoich.:	AB2C11D16 (1)
Weight, g/mol:	292.082347
ΔH_f, kcal/mol:	89.27
Dipole, Da:	3.42
IP(EA), eV:	-8.7(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[4-(difluoromethoxy)anilino]methyl]-2-fluorobenzonitrile

Drug info:

PubChemData

Smile

C#CC1=CC(=CC=C1)NCC2=C(C(=CC=C2)C#N)F

DOS

IR

Vibrations