Geometry & MOs

Info

ID:	345486
PubChem CID:	127269786
Reduced:	SN3O4C19H27 (1)
Stoich.:	AB3C4D19E27 (1)
Weight, g/mol:	307.099063
ΔH_f, kcal/mol:	-147.22
Dipole, Da:	7.41
IP(EA), eV:	-9.03(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetyl]piperidin-4-one

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCCC2)C(=O)N3CCC(=O)CC3

DOS

IR

Vibrations