Geometry & MOs

Info

ID:	353128
PubChem CID:	127284308
Reduced:	ON2C16H18 (1)
Stoich.:	AB2C16D18 (1)
Weight, g/mol:	331.192963
ΔH_f, kcal/mol:	-4.75
Dipole, Da:	4.16
IP(EA), eV:	-9.21(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-3-methyl-2-piperidin-1-ylbutanamide

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2C1C(=O)N3CCC(CC3)C#N

DOS

IR

Vibrations