Geometry & MOs

Info

ID:	210090
PubChem CID:	80761432
Reduced:	ClSN4C13H15 (1)
Stoich.:	ABC4D13E15 (1)
Weight, g/mol:	267.068701
ΔH_f, kcal/mol:	43.34
Dipole, Da:	6.6
IP(EA), eV:	-8.61(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-2-N-(5-fluoro-2-methylphenyl)-4-N-methyl-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

CCNC1=CC(=NC(=N1)SC)NC2=CC=C(C=C2)Cl

DOS

IR

Vibrations