Geometry & MOs

Info

ID:	210085
PubChem CID:	80759954
Reduced:	BrFO2N4H8C11 (1)
Stoich.:	ABC2D4E8F11 (1)
Weight, g/mol:	292.120322
ΔH_f, kcal/mol:	8.35
Dipole, Da:	7.04
IP(EA), eV:	-9.33(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(3-chlorophenyl)-6-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Br)F)NC2=C(C=CC(=N2)N)[N+](=O)[O-]

DOS

IR

Vibrations