Geometry & MOs

Info

ID:	210848
PubChem CID:	80861668
Reduced:	O2N4C9H12 (1)
Stoich.:	A2B4C9D12 (1)
Weight, g/mol:	254.174276
ΔH_f, kcal/mol:	20.08
Dipole, Da:	3.03
IP(EA), eV:	-9.55(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-4-methoxy-6-(4-methylpentoxy)-1,3,5-triazin-2-amine

Drug info:

PubChemData

Smile

CCNC1=NC(=NC(=N1)OCC#C)OC

DOS

IR

Vibrations