Geometry & MOs

Info

ID:	5516
PubChem CID:	13263
Reduced:	SN5C9H17 (1)
Stoich.:	AB5C9D17 (1)
Weight, g/mol:	227.120467
ΔH_f, kcal/mol:	21.05
Dipole, Da:	2.6
IP(EA), eV:	-8.72(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-ethyl-6-methylsulfanyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

CCNC1=NC(=NC(=N1)SC)NC(C)C

DOS

IR

Vibrations