Geometry & MOs

Info

ID:	356237
PubChem CID:	127291310
Reduced:	SO2F3N3C16H24 (1)
Stoich.:	AB2C3D3E16F24 (1)
Weight, g/mol:	381.169783
ΔH_f, kcal/mol:	-250.46
Dipole, Da:	6.6
IP(EA), eV:	-9.22(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC(C1)C(=O)N2CSCC2C(=O)NCC3CCN(C3)CC(F)(F)F

DOS

IR

Vibrations