Geometry & MOs

Info

ID:	263521
PubChem CID:	103375395
Reduced:	O2N5C13H17 (1)
Stoich.:	A2B5C13D17 (1)
Weight, g/mol:	319.92288
ΔH_f, kcal/mol:	-2.19
Dipole, Da:	8.62
IP(EA), eV:	-9.57(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-iodo-3-(6-methoxypyridazin-3-yl)-1,2,4-thiadiazole

Drug info:

PubChemData

Smile

CCCNCC1=CC(=O)N=C(N1)C2=NN=C(C=C2)OC

DOS

IR

Vibrations