Geometry & MOs

Info

ID:	362478
PubChem CID:	127308017
Reduced:	OSN4C16H20 (1)
Stoich.:	ABC4D16E20 (1)
Weight, g/mol:	311.130363
ΔH_f, kcal/mol:	15.45
Dipole, Da:	5.24
IP(EA), eV:	-9.04(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-hydroxy-3-[2-(1,3-thiazol-2-yl)morpholin-4-yl]propyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC(C)C1C(=O)NCCN1CC2=CSC(=N2)C3=CC=CC=N3

DOS

IR

Vibrations