Geometry & MOs

Info

ID:	374684
PubChem CID:	131342447
Reduced:	FNC5H5 (2)
Stoich.:	ABC5D5 (2)
Weight, g/mol:	196.081205
ΔH_f, kcal/mol:	-45.02
Dipole, Da:	6.21
IP(EA), eV:	-9.49(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-difluoro-4-[2-(methylamino)ethyl]benzonitrile

Drug info:

PubChemData

Smile

CNCCC1=CC(=C(C(=C1)F)C#N)F

DOS

IR

Vibrations