Geometry & MOs

Info

ID:	129459
PubChem CID:	51072658
Reduced:	NO4C13H17 (1)
Stoich.:	AB4C13D17 (1)
Weight, g/mol:	238.113984
ΔH_f, kcal/mol:	-136.52
Dipole, Da:	3.54
IP(EA), eV:	-8.65(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylpiperidin-1-yl)-2-(2-methyl-1,3-thiazol-4-yl)ethanone

Drug info:

PubChemData

Smile

CN(CC1=CC2=C(C=C1)OCCO2)C(=O)COC

DOS

IR

Vibrations