Geometry & MOs

Info

ID:	240829
PubChem CID:	93617720
Reduced:	OSN2C11H16 (1)
Stoich.:	ABC2D11E16 (1)
Weight, g/mol:	293.069734
ΔH_f, kcal/mol:	-29.78
Dipole, Da:	3.25
IP(EA), eV:	-9.35(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]-2-(2,2,2-trifluoroethoxy)ethanone

Drug info:

PubChemData

Smile

C[C@@H]1CCCCN1C(=O)C2=C(N=CS2)C

DOS

IR

Vibrations