Accuracy

Au(III)N3Cl(2plus) (AEMAUP) r   7843 Au(III)N3Cl(2+) (AEMAUP) (Geo)

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    #  Species Formula
  7833 Gold(III) difluoride thiol (Geo)HF2SAu
  7834 Gold(III) difluoride thiolHF2SAu
  7835 Au(Me2S)2C4H12S2Au
  7836 Au(Me2S)2 (Geo)C4H12S2Au
  7837 Au(I)S2(+) (AFAWUZ) (Geo)C2H8N4S2Au
  7838 Au(I)S2(+) (AFAWUZ)C2H8N4S2Au
  7839 Au(IV)S4 (JEKGAH) (Geo)C12H8S4Au
  7840 Au(IV)S4 (JEKGAH)C12H8S4Au
  7841 Gold(I) chloride (Geo)ClAu
  7842 Gold(I) chlorideClAu
  7843 Au(III)N3Cl(2+) (AEMAUP) (Geo) C4H13N3ClAu
  7844 Au(I)SCl (GOJLAS) (Geo)C2H6SClAu
  7845 Au(I)Cl2(-) (GANJOU) (Geo)Cl2Au
  7846 Gold(I) dichloride, anionCl2Au
  7847 Methyl gold(III) dichloride (Geo)CH3Cl2Au
  7848 Au(III)Cl2N2(+) (BATTOF) (Geo)C11H10N2O2Cl2Au
  7849 Au(III)Cl2ON (KUDNAY) (Geo)C6H3NO3Cl2Au
  7850 Au(III)NCl3 (PYAUCL10) (Geo)C5H5NCl3Au
  7851 Au(III)NCl3 (HIHCIK) (Geo)C6H7NOCl3Au
  7852 Au(III)Cl4(-) (BENYAU) (Geo)Cl4Au
  7853 Gold(iii) tetrachloride, anionCl4Au


REF: The Cambridge Structural Database: a quarter of a million crystal structures and rising. F. H. Allen, Acta Cryst. B58, 380-388, (2002)
  
 CHARGE=2 UHF RELSCF=50 PULAY PM7
Au(III)N3Cl(2+) (AEMAUP)
 <Au-Cl> <Au-N><N-Au-Cl> <Au-N'> GR=CCDC
 Au     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Cl     2.27395900 +1    0.0000000 +0    0.0000000 +0     1     0     0
  N     1.97166600 +1   93.7280530 +1    0.0000000 +0     1     2     0
  N     2.04638100 +1   88.4470867 +1  179.5978486 +1     1     3     2
  N     1.89913786 +1   87.9417514 +1 -177.1879121 +1     1     2     3
  C     1.51911920 +1  107.6254126 +1 -177.4833640 +1     3     1     2
  C     1.50792021 +1  102.6599178 +1  -28.4233939 +1     4     1     3
  C     1.50703422 +1  102.4346662 +1 -121.7761246 +1     4     1     7
  C     1.52779179 +1  108.1698896 +1  178.5120217 +1     5     1     2
  H     1.13023036 +1  109.3465516 +1  147.2046828 +1     6     3     1
  H     1.12356869 +1  108.5897939 +1  115.1325466 +1     6     3    10
  H     1.12794106 +1  111.1731468 +1  168.7547653 +1     7     4     1
  H     1.12006265 +1  110.2478554 +1  116.9015891 +1     7     4    12
  H     1.12838819 +1  111.2809134 +1 -166.2683920 +1     8     4     1
  H     1.12031160 +1  110.3910250 +1 -116.9196235 +1     8     4    14
  H     1.12398436 +1  108.4462162 +1   97.5060360 +1     9     5     1
  H     1.13071185 +1  108.8047732 +1  114.9255076 +1     9     5    16
  H     1.05405608 +1  109.2164256 +1 -122.3514417 +1     3     1     6
  H     1.05443406 +1  106.8363569 +1 -116.7181555 +1     3     1    18
  H     1.05340129 +1  113.4993735 +1 -119.1699375 +1     4     1     8
  H     1.06405409 +1  108.9933524 +1  122.2895901 +1     5     1     9
  H     1.06439854 +1  106.9088543 +1  116.7173975 +1     5     1    21