Geometry & MOs

Info

ID:	12080
PubChem CID:	129779
Reduced:	FN2H5C6 (2)
Stoich.:	AB2C5D6 (2)
Weight, g/mol:	248.087353
ΔH_f, kcal/mol:	2.69
Dipole, Da:	6.0
IP(EA), eV:	-8.67(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4-difluoro-2H-1,3,5-triazin-1-yl)-2-methylisoindole

Drug info:

PubChemData

Smile

CN1C=C2C=CC=CC2=C1N3C=NC(=NC3F)F

DOS

IR

Vibrations