Geometry & MOs

Info

ID:	212544
PubChem CID:	81060910
Reduced:	FNH4C5 (3)
Stoich.:	ABC4D5 (3)
Weight, g/mol:	319.01204
ΔH_f, kcal/mol:	-94.17
Dipole, Da:	6.16
IP(EA), eV:	-9.38(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-bromo-2-fluoroanilino)-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C#N)NC2=CC=CC=C2C(F)(F)F

DOS

IR

Vibrations