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4927 Bicyclopentadienyl molybdenum dichloride

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  #           Species Formula
  4917 Bicyclopentadienyl dithioisopropyl molybdenumC16H24S2Mo
  4918 Bicyclopentadienyl dithiopropyl molybdenumC16H24S2Mo
  4919 Bicyclopentadienyl di(thio-n-butyl) molybdenumC18H28S2Mo
  4920 Bicyclopentadienyl di(thio-t-butyl) molybdenumC18H28S2Mo
  4921 Mo(VI)S2O2N2 (FINJOB) (Geo)C8H20N2O2S2Mo
  4922 Mo(VI)S2O2N2 (FINJOB)C8H20N2O2S2Mo
  4923 Mo(VI)S4(2-) (AMEHEF) (Geo)S4Mo
  4924 Mo(VI)S4(2-) (AMEHEF)S4Mo
  4925 Molybdenum(I) chloride (Geo)ClMo
  4926 Molybdenum(I) chlorideClMo
  4927 Bicyclopentadienyl molybdenum dichloride C10H10Cl2Mo
  4928 Molybdenum(VI) dichloride dioxideO2Cl2Mo
  4929 Molybdenum(VI) dioxide dichlorideO2Cl2Mo
  4930 Molybdenum dioxide dichloride (Geo)O2Cl2Mo
  4931 Mo(VI)O2Cl2N2 (AGANIF) (Geo)C10H8N2O2Cl2Mo
  4932 Mo(VI)O2Cl2N2 (AGANIF)C10H8N2O2Cl2Mo
  4933 Mo(VI)O2Cl2N2 (AGANEB) (Geo)C8H6N4O2Cl2Mo
  4934 Mo(VI)O2Cl2N2 (AGANEB)C8H6N4O2Cl2Mo
  4935 Molybdenum(III) trichlorideCl3Mo
  4936 Mo(III)Cl3O3 (BOHYEC) (Geo)C3H12N6O3Cl3Mo
  4937 Molybdenum(IV) tetrachlorideCl4Mo



DHf: 1.0 kcal/mol,     REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.

  
 SHIFT=10 PULAY UHF
Bicyclopentadienyl molybdenum dichloride
 H=1.0 HR=NIST
 Mo         0.00000000 +0    0.0000000 +0    0.0000000 +0                      0.0000
  C         2.36135845 +1    0.0000000 +0    0.0000000 +0    1    0    0       0.0000
  C         1.46729032 +1   69.3692256 +1    0.0000000 +0    2    1    0       0.0000
  C         1.46716651 +1  108.1491485 +1   66.6393446 +1    3    2    1       0.0000
  C         1.44938916 +1  106.6016268 +1    2.5825187 +1    4    3    2       0.0000
  C         1.44893349 +1   77.4469706 +1  113.3675540 +1    2    1    3       0.0000
  H         1.08211413 +1  131.3742679 +1 -120.1591129 +1    2    1    3       0.0000
  H         1.08341908 +1  124.8206579 +1 -129.4487100 +1    3    2    1       0.0000
  H         1.08209796 +1  125.9178466 +1  166.3115068 +1    4    3    2       0.0000
  H         1.08976226 +1  124.6295854 +1  176.5737132 +1    5    4    3       0.0000
  H         1.08975479 +1  124.6484547 +1  119.8454551 +1    6    2    1       0.0000
  C         2.36002129 +1   98.3025610 +1   93.8630014 +1    1    2    3       0.0000
  C         1.44960538 +1   77.4124474 +1 -149.3266904 +1   12    1    4       0.0000
  C         1.41906915 +1  109.2924852 +1   62.1875357 +1   13   12    1       0.0000
  C         1.44910441 +1  109.2960100 +1   -0.1342134 +1   14   13   12       0.0000
  C         1.46719763 +1   69.4190169 +1  -36.0038023 +1   12    1    4       0.0000
  H         1.08210504 +1  131.4915529 +1   84.2651613 +1   12    1    4       0.0000
  H         1.08970493 +1  124.6214179 +1 -119.8685160 +1   13   12    1       0.0000
  H         1.08972419 +1  126.0435559 +1  177.9287791 +1   14   13   12       0.0000
  H         1.08213155 +1  125.2898337 +1  165.6965610 +1   15   14   13       0.0000
  H         1.08344517 +1  124.8520281 +1  129.3860122 +1   16   12    1       0.0000
 Cl         2.42751643 +1   90.2260651 +1 -175.8321184 +1    1    2    3       0.0000
 Cl         2.42732999 +1  129.9842347 +1 -100.7107401 +1    1    2    3       0.0000