Geometry & MOs

Info

ID:	211049
PubChem CID:	80888855
Reduced:	ClSN5H8C9 (1)
Stoich.:	ABC5D8E9 (1)
Weight, g/mol:	264.07933
ΔH_f, kcal/mol:	88.68
Dipole, Da:	2.44
IP(EA), eV:	-8.99(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-propoxy-6-pyrimidin-4-ylsulfanyl-1,3,5-triazin-2-amine

Drug info:

PubChemData

Smile

CNC1=NC=C(C(=N1)SC2=NC=NC=C2)Cl

DOS

IR

Vibrations