Geometry & MOs

Info

ID:	5842
PubChem CID:	13894
Reduced:	SN5C7H13 (1)
Stoich.:	AB5C7D13 (1)
Weight, g/mol:	199.089167
ΔH_f, kcal/mol:	30.58
Dipole, Da:	4.64
IP(EA), eV:	-9.12(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-bis(ethylamino)-1,3,5-triazine-2-thiol

Drug info:

PubChemData

Smile

CCNC1=NC(=NC(=N1)S)NCC

DOS

IR

Vibrations