# Species Formula 4941 Technetium pentacarbonyl, anionC5O5Tc 4942 Tc(II)(H2O)6 6AgH12O6Tc 4943 Tc(II)(H2O)6H12O6Tc 4944 Tc(II)(H2O)6 (Geo)H12O6Tc 4945 Technetium hexacarbonyl, cation (Geo)C6O6Tc 4946 Technetium hexacarbonyl, cationC6O6Tc 4947 Tc(III)O6 (KABMIJ) (Geo)C15H21O6Tc 4948 Tc(III)O6 (KABMIJ)C15H21O6Tc 4949 Tc(IV)O6 (VOFHAZ) (Geo)C14H30N2O6Tc 4950 Tc(IV)O6 (VOFHAZ)C14H30N2O6Tc 4951 Technetium(I) fluoride (Geo) FTc 4952 Technetium(III) oxide fluoride (Geo)OFTc 4953 Technetium(III) oxide fluorideOFTc 4954 Tc(CO)5FC5O5FTc 4955 Tc(CO)5F (Geo)C5O5FTc 4956 Technetium(III) trifluoride (Geo)F3Tc 4957 Technetium(III) trifluorideF3Tc 4958 Tc(V)C4NO(2-) (PAFHAF) (Geo)C5N5OSTc 4959 Tc(V)C4NO(2-) (PAFHAF)C5N5OSTc 4960 Tc(V)N2S2O2(+) (SOXMIB) (Geo)C12H26N2O2S2Tc 4961 Tc(V)N2S2O2(+) (SOXMIB)C12H26N2O2S2Tc
UHF FIELD=(0.01,0.02,0.03) RELSCF=1.D-3 SHIFT=30 PULAY PM7 Technetium(I) fluoride <Tc-F> GR=PW91D Tc 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0 F 1.95448000 +1 0.0000000 +0 0.0000000 +0 1 0 0