Geometry & MOs

Info

ID:	208969
PubChem CID:	80608416
Reduced:	OSN3C14H19 (1)
Stoich.:	ABC3D14E19 (1)
Weight, g/mol:	267.151767
ΔH_f, kcal/mol:	15.87
Dipole, Da:	3.11
IP(EA), eV:	-8.86(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]-1,3,4-thiadiazol-2-amine

Drug info:

PubChemData

Smile

CCCNC1=NN=C(S1)COC2=CC=CC=C2CC

DOS

IR

Vibrations