Accuracy

molybdenum(v) pentachloride   4877 Molybdenum(V) pentachloride

(Previous)     (Back)     (Next)         Geometry predicted using PM7

    

    #  Species Formula
  4867 Mo(VI)O2Cl2N2 (AGANEB) (Geo)C8H6N4O2Cl2Mo
  4868 Mo(VI)O2Cl2N2 (AGANEB)C8H6N4O2Cl2Mo
  4869 Molybdenum(III) trichlorideCl3Mo
  4870 Mo(III)Cl3O3 (BOHYEC) (Geo)C3H12N6O3Cl3Mo
  4871 Molybdenum(IV) tetrachlorideCl4Mo
  4872 Molybdenum(VI) oxide tetrachlorideOCl4Mo
  4873 Molybdenum oxide tetrachloride (Geo)OCl4Mo
  4874 Mo(V)Cl4O(-) (IWELOL) (Geo)OCl4Mo
  4875 Mo(V)Cl4O(-) (IWELOL)OCl4Mo
  4876 Molybdenum pentachloride (Geo)Cl5Mo
  4877 Molybdenum(V) pentachloride Cl5Mo
  4878 Molybdenum(VI) hexachloride (Geo)Cl6Mo
  4879 Molybdenum(VI) hexachlorideCl6Mo
  4880 CrMo(ac)4 (Geo)C8H12O8CrMo
  4881 Molybdenum Chromium tetraacetateC8H12O8CrMo
  4882 Molybdenum(I) bromide (Geo)BrMo
  4883 Molybdenum(I) bromideBrMo
  4884 Molybdenum(II) dibromideBr2Mo
  4885 Bicyclopentadienyl molybdenum dibromideC10H10Br2Mo
  4886 Mo(Cp)2Br2C10H10Br2Mo
  4887 Molybdenum(VI) dibromide dioxideO2Br2Mo


ΔHf: -107.5 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.
  
 UHF GNORM=0.02 SHIFT=80 PM7
Molybdenum(V) pentachloride
 H=-107.5 HR=NIST
 Mo     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Cl     2.24569243 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Cl     2.31981738 +1  113.9987588 +1    0.0000000 +0     1     2     0
 Cl     2.31975803 +1  113.9481519 +1   89.9874110 +1     1     2     3
 Cl     2.31976621 +1  113.9673706 +1  179.9675121 +1     1     2     3
 Cl     2.31982105 +1  114.0104096 +1  -90.0227607 +1     1     2     3