Geometry & MOs

Info

ID:	354492
PubChem CID:	127287041
Reduced:	OSN3C14H25 (1)
Stoich.:	ABC3D14E25 (1)
Weight, g/mol:	253.124883
ΔH_f, kcal/mol:	-64.13
Dipole, Da:	2.7
IP(EA), eV:	-8.73(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyano-N-(thian-4-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CCN2CCN(CC2C1)C(=O)NC3CCSCC3

DOS

IR

Vibrations