Accuracy

(ga(iii)f2.(me2n))(plus)r   3813 [Ga(III)F2.(Me2N)](+) (Geo)

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    #  Species Formula
  3803 Gallium (III) EDTAC10H12N2O8Ga
  3804 Ga(III)(EDTA) (EDTAGA01) (Geo)C10H15N2O9Ga
  3805 Ga(III)(EDTA) (EDTAGA01)C10H15N2O9Ga
  3806 Ga(III)O6(3-) (COKFIR) (Geo)C6O12Ga
  3807 Ga(III)O6(3-) (COKFIR)C6O12Ga
  3808 Gallium fluoride (Geo)FGa
  3809 Gallium fluorideFGa
  3810 Ga(III)C2F2(-) (CUPQUZ) (Geo)C2H6F2Ga
  3811 Ga(III)C2F2(-) (CUPQUZ)C2H6F2Ga
  3812 [Ga(III)F2.(Me2N)](+)C2H6NF2Ga
  3813 [Ga(III)F2.(Me2N)](+) (Geo) C2H6NF2Ga
  3814 Gallium trifluoride (Geo)F3Ga
  3815 Gallium trifluorideF3Ga
  3816 Ga(III)F6(3-) (BUYFOQ01) (Geo)F6Ga
  3817 Ga(III)F6(3-) (BUYFOQ01)F6Ga
  3818 Ga(CH3O)2(CH3S)C3H9O2SGa
  3819 Ga(CH3O)2(CH3S) (Geo)C3H9O2SGa
  3820 [Ga(III)F2](+).H2SH2F2SGa
  3821 [Ga(III)F2](+).H2S (Geo)H2F2SGa
  3822 Ga(III)S6 (EDTCGA01) (Geo)C15H30N3S6Ga
  3823 Ga(III)S6 (EDTCGA01)C15H30N3S6Ga


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.
  
 CHARGE=1 PM7
[Ga(III)F2.(Me2N)](+)
 <Ga-F> <><> <Ga-N> GR=PW91D
 Ga     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  F     1.74992400 +1    0.0000000 +0    0.0000000 +0     1     0     0
  F     1.74539005 +1  131.9529811 +1    0.0000000 +0     1     2     0
  N     1.95942200 +1  113.8717590 +1 -179.1631026 +1     1     2     3
  C     1.42582107 +1  121.0699939 +1  174.7617953 +1     4     1     2
  C     1.42658897 +1  120.4585822 +1 -179.4865668 +1     4     1     5
  H     1.11504167 +1  114.4784083 +1 -158.0278744 +1     5     4     1
  H     1.11781330 +1  113.2193050 +1  123.0659374 +1     5     4     7
  H     1.12705542 +1  110.8726644 +1  117.9503100 +1     5     4     8
  H     1.11412142 +1  114.6257631 +1 -168.1116931 +1     6     4     1
  H     1.12003364 +1  112.6099858 +1  122.3071210 +1     6     4    10
  H     1.12535168 +1  111.2998276 +1  117.6122133 +1     6     4    11