Geometry & MOs

Info

ID:	352500
PubChem CID:	127283588
Reduced:	OSN5C11H17 (1)
Stoich.:	ABC5D11E17 (1)
Weight, g/mol:	288.104482
ΔH_f, kcal/mol:	29.55
Dipole, Da:	10.37
IP(EA), eV:	-8.59(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methylidenepiperidin-1-yl)-[2-(1-methylpyrazol-4-yl)-1,3-thiazol-4-yl]methanone

Drug info:

PubChemData

Smile

CN1C(=NN=N1)SCCC(=O)N2CCC(=C)CC2

DOS

IR

Vibrations