Geometry & MOs

Info

ID:	352557
PubChem CID:	127283645
Reduced:	SN3O3C13H21 (1)
Stoich.:	AB3C3D13E21 (1)
Weight, g/mol:	313.146013
ΔH_f, kcal/mol:	-139.26
Dipole, Da:	5.93
IP(EA), eV:	-9.16(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(3,3-dimethylbutanoyl)-1,3-thiazolidine-4-carbonyl]piperazin-2-one

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)N1CSCC1C(=O)N2CCNC(=O)C2

DOS

IR

Vibrations