Geometry & MOs

Info

ID:	5234
PubChem CID:	12806
Reduced:	F3C4H4N5 (1)
Stoich.:	A3B4C4D5 (1)
Weight, g/mol:	179.04188
ΔH_f, kcal/mol:	-107.01
Dipole, Da:	5.17
IP(EA), eV:	-10.17(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(trifluoromethyl)-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

C1(=NC(=NC(=N1)N)N)C(F)(F)F

DOS

IR

Vibrations