Geometry & MOs

Info

ID:	202848
PubChem CID:	79733826
Reduced:	FOCl2N2H5C10 (1)
Stoich.:	ABC2D2E5F10 (1)
Weight, g/mol:	287.185844
ΔH_f, kcal/mol:	-20.12
Dipole, Da:	2.48
IP(EA), eV:	-9.67(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1-ethylimidazol-2-yl)methyl]-N-methyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine

Drug info:

PubChemData

Smile

C1=C(C=NC=C1Cl)OC2=C(C=C(C=N2)Cl)F

DOS

IR

Vibrations