Geometry & MOs

Info

ID:	246880
PubChem CID:	103065302
Reduced:	SN3C9H13 (1)
Stoich.:	AB3C9D13 (1)
Weight, g/mol:	255.115381
ΔH_f, kcal/mol:	24.94
Dipole, Da:	3.85
IP(EA), eV:	-8.46(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-ethoxy-4-N-methyl-2-N-(thiolan-3-yl)-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

C1CSCC1NC2=CN=CC(=C2)N

DOS

IR

Vibrations