Geometry & MOs

Info

ID:	246875
PubChem CID:	103065268
Reduced:	OSN6C11H18 (1)
Stoich.:	ABC6D11E18 (1)
Weight, g/mol:	294.162666
ΔH_f, kcal/mol:	-1.99
Dipole, Da:	1.46
IP(EA), eV:	-8.71(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-ethyl-6-pyrrolidin-1-yl-2-N-(thiolan-3-yl)-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

C1CSCC1NC2=NC(=NC(=N2)N)N3CCOCC3

DOS

IR

Vibrations