Geometry & MOs

Info

ID:	167821
PubChem CID:	74883141
Reduced:	NOSC7H9 (2)
Stoich.:	ABCD7E9 (2)
Weight, g/mol:	241.088498
ΔH_f, kcal/mol:	-44.35
Dipole, Da:	4.29
IP(EA), eV:	-8.98(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3,3a,4,5,6,6a-hexahydro-2H-pyrrolo[2,3-c]pyrrole-1-carbonyl)-1,3-thiazolidin-2-one

Drug info:

PubChemData

Smile

CCOCCN1C(=O)C2C3=C(CCCC3)SC2=NC1=S

DOS

IR

Vibrations