Geometry & MOs

Info

ID:	430448
PubChem CID:	135170512
Reduced:	OSN3C6H9 (1)
Stoich.:	ABC3D6E9 (1)
Weight, g/mol:	172.030649
ΔH_f, kcal/mol:	-3.05
Dipole, Da:	5.94
IP(EA), eV:	-9.87(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-methyl-1,2,4-thiadiazole-3-carboxylate

Drug info:

PubChemData

Smile

CCNC(=O)C1=NSC(=N1)C

DOS

IR

Vibrations