Geometry & MOs

Info

ID:	348996
PubChem CID:	127274722
Reduced:	NSO3C16H23 (1)
Stoich.:	ABC3D16E23 (1)
Weight, g/mol:	343.156577
ΔH_f, kcal/mol:	-125.62
Dipole, Da:	2.38
IP(EA), eV:	-8.51(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-butanoyl-N-(3-morpholin-4-yl-3-oxopropyl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CCOC(C1)CSCC(=O)NC2CCCC3=C2C=CO3

DOS

IR

Vibrations