Geometry & MOs

Info

ID:	211086
PubChem CID:	80895360
Reduced:	S2N5C8H9 (1)
Stoich.:	A2B5C8D9 (1)
Weight, g/mol:	245.954914
ΔH_f, kcal/mol:	92.41
Dipole, Da:	4.46
IP(EA), eV:	-9.16(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-6-(1,2,4-thiadiazol-5-ylsulfanyl)-1,3,5-triazin-2-amine

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)NC)SC2=NC=NS2

DOS

IR

Vibrations