Geometry & MOs

Info

ID:	375078
PubChem CID:	131465808
Reduced:	SN5C8H11 (1)
Stoich.:	AB5C8D11 (1)
Weight, g/mol:	209.073517
ΔH_f, kcal/mol:	74.75
Dipole, Da:	2.69
IP(EA), eV:	-9.39(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-aminopiperidin-1-yl)-1,2,4-thiadiazole-5-carbonitrile

Drug info:

PubChemData

Smile

C1CSCC2=NC(=NN21)CC(C#N)N

DOS

IR

Vibrations