Geometry & MOs

Info

ID:	362999
PubChem CID:	127310020
Reduced:	SF3N3O3C13H18 (1)
Stoich.:	AB3C3D3E13F18 (1)
Weight, g/mol:	381.133397
ΔH_f, kcal/mol:	-293.84
Dipole, Da:	3.62
IP(EA), eV:	-9.37(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-methylbutanoyl)-N-[2-oxo-1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)N1CSCC1C(=O)NC2CCN(C2=O)CC(F)(F)F

DOS

IR

Vibrations