Geometry & MOs

Info

ID:	272241
PubChem CID:	103736540
Reduced:	ON3C13H17 (1)
Stoich.:	AB3C13D17 (1)
Weight, g/mol:	209.098669
ΔH_f, kcal/mol:	14.33
Dipole, Da:	7.04
IP(EA), eV:	-8.85(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopropyl-N-(2-ethylcyclopropyl)-1,2,4-thiadiazol-5-amine

Drug info:

PubChemData

Smile

COCC1CCCN(C1)C2=CN=C(C=C2)C#N

DOS

IR

Vibrations