Geometry & MOs

Info

ID:	210834
PubChem CID:	80859477
Reduced:	ClFO3N4H6C10 (1)
Stoich.:	ABC3D4E6F10 (1)
Weight, g/mol:	337.05382
ΔH_f, kcal/mol:	-15.19
Dipole, Da:	5.83
IP(EA), eV:	-9.61(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2-bromophenoxy)-4-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)[N+](=O)[O-])OC2=NC(=NC=C2F)N

DOS

IR

Vibrations