Geometry & MOs

Info

ID:	345480
PubChem CID:	127269780
Reduced:	O2N3C18H21 (1)
Stoich.:	A2B3C18D21 (1)
Weight, g/mol:	268.088164
ΔH_f, kcal/mol:	-38.71
Dipole, Da:	5.69
IP(EA), eV:	-9.13(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-3-[3-oxo-3-(4-oxopiperidin-1-yl)propyl]-1,3-thiazol-2-one

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C2=CC=CC=C2)C)CC(=O)N3CCC(=O)CC3

DOS

IR

Vibrations