Geometry & MOs

Info

ID:	210343
PubChem CID:	80792129
Reduced:	ON4C15H26 (1)
Stoich.:	AB4C15D26 (1)
Weight, g/mol:	294.155272
ΔH_f, kcal/mol:	-40.46
Dipole, Da:	2.87
IP(EA), eV:	-8.52(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-[2-(2-methoxyethoxy)ethyl]-4-N-methyl-6-(1,2,4-triazol-1-yl)-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

CCCC1=C(N=CN=C1N2CCCC(C2)CO)NCC

DOS

IR

Vibrations