Geometry & MOs

Info

ID:	209453
PubChem CID:	80675587
Reduced:	BrSO2N4C9H15 (1)
Stoich.:	ABC2D4E9F15 (1)
Weight, g/mol:	289.02891
ΔH_f, kcal/mol:	-35.52
Dipole, Da:	6.0
IP(EA), eV:	-9.09(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-1-[3-(2,2,2-trifluoroethoxy)propyl]pyrrolidine

Drug info:

PubChemData

Smile

C1CN(CCN1CCBr)S(=O)(=O)C2=CNN=C2

DOS

IR

Vibrations