Geometry & MOs

Info

ID:	5268
PubChem CID:	12871
Reduced:	F3N5C8H12 (1)
Stoich.:	A3B5C8D12 (1)
Weight, g/mol:	235.10448
ΔH_f, kcal/mol:	-123.39
Dipole, Da:	6.11
IP(EA), eV:	-9.63(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCNC1=NC(=NC(=N1)C(F)(F)F)NCC

DOS

IR

Vibrations