PM7 Accuracy Date:Mon Feb 11 04:20:05 2019

Cu(II)Cl4(2-) (AGAWIO)   3688 Cu(II)Cl4(2-) (AGAWIO)

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    #  Species Formula
  3678 Copper(II) dichloride, dihydrate (Geo)H4O2Cl2Cu
  3679 Cu(II)O2Cl2 (CETDCU10) (Geo)C2H6O2Cl2Cu
  3680 Cu(II)O2Cl2 (CETDCU10)C2H6O2Cl2Cu
  3681 Cu(II)Cl2O2N2 (AQCYCU) (Geo)C4H12N8O2Cl2Cu
  3682 Cu(II)Cl2O2N2 (AQCYCU)C4H12N8O2Cl2Cu
  3683 Cu(II)Cl2S2 (BOSMIF) (Geo)C6H14S2Cl2Cu
  3684 Cu(II)Cl2S2 (BOSMIF)C6H14S2Cl2Cu
  3685 Copper(II) trichloride, anionCl3Cu
  3686 Copper(II) trichloride, anion (Geo)Cl3Cu
  3687 Cu(II)Cl4(2-) (AGAWIO) (Geo)Cl4Cu
  3688 Cu(II)Cl4(2-) (AGAWIO) Cl4Cu
  3689 Copper(II) tetrachloride, dianion (Geo)Cl4Cu
  3690 Copper dimerCu2
  3691 Cu-Cu (Geo)Cu2
  3692 Cu(II)2O10 (ACURCU02) (Geo)C10H20N4O10Cu2
  3693 Cu(II)2O10 (ACURCU02)C10H20N4O10Cu2
  3694 Cu(II)2N2O2Cl2S2 (BICTAI) (Geo)C12H28N2O2S2Cl2Cu2
  3695 Cu(II)2N2O2Cl2S2 (BICTAI)C12H28N2O2S2Cl2Cu2
  3696 Cu(II)2Cl6(2-) (BPYCCU) (Geo)Cl6Cu2
  3697 Cu(II)2Cl6(2-) (BPYCCU)Cl6Cu2
  3698 Copper(I) chloride, trimer (Geo)Cl3Cu3


ΔHf: -124.4 kcal/mol,     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 CHARGE=-2 PM7
Cu(II)Cl4(2-) (AGAWIO)
 H=-124.4 HR=PW91D
 Cu     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Cl     2.29097758 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Cl     2.29281787 +1  110.1502940 +1    0.0000000 +0     1     2     0
 Cl     2.29423367 +1  109.1730733 +1  120.0588404 +1     1     2     3
 Cl     2.29263562 +1  108.4186871 +1  119.9965935 +1     1     2     4