Geometry & MOs

Info

ID:	349512
PubChem CID:	127275399
Reduced:	SO2N5C17H25 (1)
Stoich.:	AB2C5D17E25 (1)
Weight, g/mol:	250.088832
ΔH_f, kcal/mol:	-36.04
Dipole, Da:	2.19
IP(EA), eV:	-9.02(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyano-N-(5-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)CC2=CSC(=N2)NC(=O)N3CCC(CC3)C#N

DOS

IR

Vibrations