Geometry & MOs

Info

ID:	356358
PubChem CID:	127291431
Reduced:	SN3O3C19H31 (1)
Stoich.:	AB3C3D19E31 (1)
Weight, g/mol:	383.224263
ΔH_f, kcal/mol:	-136.64
Dipole, Da:	5.37
IP(EA), eV:	-8.68(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,2-dimethylpropanoyl)-N-[(4-pyrrolidin-1-yloxan-4-yl)methyl]-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CCN(C1)C2(CCOCC2)CNC(=O)C3CSCN3C(=O)C4CCC4

DOS

IR

Vibrations