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5011 Technetium(I) fluoride (Geo)

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  #           Species Formula
  5001 Technetium pentacarbonyl, anionC5O5Tc
  5002 Tc(II)(H2O)6 6AgH12O6Tc
  5003 Tc(II)(H2O)6H12O6Tc
  5004 Tc(II)(H2O)6 (Geo)H12O6Tc
  5005 Technetium hexacarbonyl, cation (Geo)C6O6Tc
  5006 Technetium hexacarbonyl, cationC6O6Tc
  5007 Tc(III)O6 (KABMIJ) (Geo)C15H21O6Tc
  5008 Tc(III)O6 (KABMIJ)C15H21O6Tc
  5009 Tc(IV)O6 (VOFHAZ) (Geo)C14H30N2O6Tc
  5010 Tc(IV)O6 (VOFHAZ)C14H30N2O6Tc
  5011 Technetium(I) fluoride (Geo) FTc
  5012 Technetium(III) oxide fluoride (Geo)OFTc
  5013 Technetium(III) oxide fluorideOFTc
  5014 Tc(CO)5FC5O5FTc
  5015 Tc(CO)5F (Geo)C5O5FTc
  5016 Technetium(III) trifluoride (Geo)F3Tc
  5017 Technetium(III) trifluorideF3Tc
  5018 Tc(V)C4NO(2-) (PAFHAF) (Geo)C5N5OSTc
  5019 Tc(V)C4NO(2-) (PAFHAF)C5N5OSTc
  5020 Tc(V)N2S2O2(+) (SOXMIB) (Geo)C12H26N2O2S2Tc
  5021 Tc(V)N2S2O2(+) (SOXMIB)C12H26N2O2S2Tc



REF: Estimated from DGauss results of DFT calculations, using the B88-PW91 functional and the DZVP basis set, in CAChe 6.0, Fujitsu Ltd, 2003.

  
 UHF FIELD=(0.01,0.02,0.03) RELSCF=1.D-3 SHIFT=30 PULAY
Technetium(I) fluoride
 <Tc-F> GR=PW91D
 Tc         0.00000000 +0    0.0000000 +0    0.0000000 +0                      0.0000
  F         1.95448000 +1    0.0000000 +0    0.0000000 +0    1    0    0       0.0000