Geometry & MOs

Info

ID:	349011
PubChem CID:	127274737
Reduced:	SO2N3C22H23 (1)
Stoich.:	AB2C3D22E23 (1)
Weight, g/mol:	341.213698
ΔH_f, kcal/mol:	-24.9
Dipole, Da:	4.84
IP(EA), eV:	-8.65(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-butanoyl-N-[2-(3-methylpiperidin-1-yl)propyl]-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)NC2CC3=CC=CC=C3OC2)C4=NC5=CC=CC=C5S4

DOS

IR

Vibrations