Accuracy

pb(cp)2r   8084 Bicyclopentadienyllead (plumbocene) (Geo)

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    #  Species Formula
  8074 Lithium plumbideLiPb
  8075 Trimethyllead, cationC3H9Pb
  8076 TrimethylleadC3H9Pb
  8077 Pb(IV)C4 (VADRAU) (Geo)C4H12Pb
  8078 Pb(IV)C4 (VADRAU)C4H12Pb
  8079 Tetramethyllead (Geo)C4H12Pb
  8080 TetramethylleadC4H12Pb
  8081 t-ButyltrimethylleadC7H18Pb
  8082 TetraethylleadC8H20Pb
  8083 Bicyclopentadienyllead (plumbocene)C10H10Pb
  8084 Bicyclopentadienyllead (plumbocene) (Geo) C10H10Pb
  8085 Pb(II)(Cp)2N2 (TODHOJ01) (Geo)C16H26N2Pb
  8086 Pb(II)(Cp)2N2 (TODHOJ01)C16H26N2Pb
  8087 Lead oxideOPb
  8088 Lead oxide (Geo)OPb
  8089 Lead dioxideO2Pb
  8090 Pb(II)O2(+) (AMBOPB) (Geo)C7H6NO2Pb
  8091 Pb(II)O2(+) (AMBOPB)C7H6NO2Pb
  8092 Pb(II)O4 (ABZOPB) (Geo)C14H12N2O4Pb
  8093 Pb(II)O4 (ABZOPB)C14H12N2O4Pb
  8094 Pb(II)O3N2 (LEWPIM) (Geo)C6H6N6O5Pb


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
Bicyclopentadienyllead (plumbocene)
 <Pb-C> GR=PW91D
 Pb     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     2.86825600 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.36650351 +1  113.8363455 +1    0.0000000 +0     2     1     0
  C     2.33443322 +1   70.9290786 +1   58.3600067 +1     2     1     3
  C     1.45566298 +1  108.7129122 +1   58.3068417 +1     3     2     1
  H     2.22663955 +1   64.9506532 +1   62.8059423 +1     2     1     4
  H     1.07022042 +1  100.2889032 +1   99.8377743 +1     2     1     6
  H     1.06963102 +1  127.7536741 +1  179.3413754 +1     3     2     5
  H     1.06979438 +1  160.6050227 +1   61.6776043 +1     4     2     1
  H     1.07033969 +1  123.4157487 +1  178.8664043 +1     5     3     2
  C     3.05052815 +1  142.2751701 +1  -71.2724950 +1     1     2     3
  C     1.47998912 +1   46.5029134 +1  -56.1667426 +1    11     1     2
  C     1.48072557 +1  104.3560163 +1 -110.3100706 +1    12    11     1
  C     1.36388329 +1  115.1303898 +1  -92.8093037 +1    11     1    12
  C     1.45773999 +1  108.8382136 +1   52.1222102 +1    14    11     1
  H     1.06929629 +1  101.8930465 +1 -142.3531932 +1    11     1    14
  H     1.08651666 +1  118.0463872 +1 -133.4381581 +1    12    11    13
  H     1.06902224 +1  123.1701607 +1 -175.7051062 +1    13    12    11
  H     1.07016637 +1  127.8137563 +1  178.9845107 +1    14    11    15
  H     1.07025209 +1  123.3284157 +1  178.9831981 +1    15    14    11
  C     1.08274425 +1   34.8260311 +1  -52.9609232 +1     6     2     1