Geometry & MOs

Info

ID:	242263
PubChem CID:	96099704
Reduced:	O2N7C15H17 (1)
Stoich.:	A2B7C15D17 (1)
Weight, g/mol:	342.136176
ΔH_f, kcal/mol:	58.69
Dipole, Da:	3.45
IP(EA), eV:	-9.53(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,1-dioxo-1,2-thiazolidin-2-yl)-1-[(2R)-2-(5-ethyl-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CCC1=NC(=NO1)[C@@H]2CCCN2C(=O)CC3=NN4C=CC=NC4=N3

DOS

IR

Vibrations