Geometry & MOs

Info

ID:	349006
PubChem CID:	127274732
Reduced:	OSN5C21H25 (1)
Stoich.:	ABC5D21E25 (1)
Weight, g/mol:	329.177313
ΔH_f, kcal/mol:	22.56
Dipole, Da:	7.11
IP(EA), eV:	-8.46(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-butanoyl-N-(2-morpholin-4-ylpropyl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CN1C2=C(C=N1)C(CCC2)NC(=O)C3CCN(CC3)C4=NC5=CC=CC=C5S4

DOS

IR

Vibrations