Geometry & MOs

Info

ID:	210357
PubChem CID:	80796252
Reduced:	OSN4C15H20 (1)
Stoich.:	ABC4D15E20 (1)
Weight, g/mol:	264.144707
ΔH_f, kcal/mol:	16.4
Dipole, Da:	4.48
IP(EA), eV:	-8.37(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(2-methoxyethyl)-2-N,4-N-dimethyl-6-(1,2,4-triazol-1-yl)-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

CCNC1=CC(=NC(=N1)SC)N(C)C2=CC=C(C=C2)OC

DOS

IR

Vibrations