Geometry & MOs

Info

ID:	210454
PubChem CID:	80809628
Reduced:	FN5C13H16 (1)
Stoich.:	AB5C13D16 (1)
Weight, g/mol:	267.099921
ΔH_f, kcal/mol:	29.07
Dipole, Da:	4.3
IP(EA), eV:	-8.76(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-4-N-methyl-2-N-(1-pyrazol-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

CCN(CC1=CC=NC=C1)C2=NC(=NC=C2F)NC

DOS

IR

Vibrations