Geometry & MOs

Info

ID:	350517
PubChem CID:	127277879
Reduced:	SN2O2C12H20 (1)
Stoich.:	AB2C2D12E20 (1)
Weight, g/mol:	389.177313
ΔH_f, kcal/mol:	-96.76
Dipole, Da:	6.96
IP(EA), eV:	-8.94(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-tert-butylbenzoyl)-N-(1-methyl-5-oxopyrrolidin-3-yl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)N1CSCC1C(=O)N2CCC(C2)C

DOS

IR

Vibrations