Accuracy

inh3-gah3r   5462 InH3-GaH3, complex (Geo)

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    #  Species Formula
  5452 In(III)S2N2Cl (TUPBAH)C10H22N2S2ClIn
  5453 In(III)C2Cl2(-) (AQIFEL) (Geo)C2H6Cl2In
  5454 In(III)C2Cl2(-) (AQIFEL)C2H6Cl2In
  5455 In(III)Cl2O2N2 (CAKCAS) (Geo)C17H15N2O2Cl2In
  5456 In(III)Cl2O2N2 (CAKCAS)C17H15N2O2Cl2In
  5457 Indium trichloride (Geo)Cl3In
  5458 Indium trichlorideCl3In
  5459 In(III)O2Cl3 (VUKKOB) (Geo)H4O2Cl3In
  5460 In(III)Cl6(3-) (FUVCAA) (Geo)Cl6In
  5461 In(III)Cl6(3-) (FUVCAA)Cl6In
  5462 InH3-GaH3, complex (Geo) H6GaIn
  5463 Indium selenideSeIn
  5464 Indium selenide, complex (Geo)SeIn
  5465 Indium bromide (Geo)BrIn
  5466 Indium bromideBrIn
  5467 In(III)C2Br2(-) (MASMBI) (Geo)C2H6Br2In
  5468 In(III)C2Br2(-) (MASMBI)C2H6Br2In
  5469 Indium tribromide (Geo)Br3In
  5470 Indium tribromideBr3In
  5471 In(III)CBr3 (PETNUX) (Geo)C6H14N2SBr3In
  5472 In(III)CBr3 (PETNUX)C6H14N2SBr3In


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.
  
 PM7
InH3-GaH3, complex
 <In-Ga> GR=PW91D
 In     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Ga     2.81189100 +1    0.0000000 +0    0.0000000 +0     1     0     0
  H     1.72471373 +1  122.9192312 +1    0.0000000 +0     1     2     0
  H     1.72846046 +1   45.4949488 +1  -90.1144696 +1     2     1     3
  H     1.54154428 +1  121.6425794 +1  -89.9633510 +1     2     1     4
  H     1.72739743 +1   45.5430166 +1  -90.0236351 +1     2     1     5
  H     1.72469998 +1  122.8701297 +1 -179.8408740 +1     1     2     3
  H     1.54156271 +1  121.6454202 +1  -90.0623734 +1     2     1     6