********************* Core Excitation Data ******************** **************** A.P. Hitchcock & D.C. Mancini **************** * * Formula: C4H6Fe(CO)3 * Name: butadiene-iron-tricarbonyl * Edge: C 1s * Alpha Formula: C7FeH6O3 * Data Source: Hitchcock * Filename: fs-0cckk.os * Ref. Code: WRH92 * Write Date: 93/06/10 * Reference: Organometallics 11 (92) 2559 * Source and Purity: Strem * Acquisition Mode: EELS, 2 deg, 2500 eV CRE mode, 0.7 eV fwhm *-------------------------------------------------------------- * No. of Spectra: 2 name1- 0fsc. name2- 0fsc.os * E (eV) Raw data Osc. Str. per atom (E-2) *-------------------------------------------------------------- 2.794403E+02 1.986173E+04 8.941978E-04 2.795904E+02 1.989842E+04 1.662108E-03 2.797404E+02 1.995576E+04 2.698256E-03 2.798905E+02 1.963579E+04 -1.117224E-03 2.800406E+02 1.984191E+04 1.835250E-03 2.801907E+02 1.961549E+04 -7.920113E-04 2.803408E+02 1.946063E+04 -2.504973E-03 2.804909E+02 1.955468E+04 -9.926255E-04 2.806410E+02 1.952592E+04 -1.073071E-03 2.807910E+02 1.952160E+04 -8.356363E-04 2.809411E+02 1.956847E+04 7.241126E-05 2.810912E+02 1.944909E+04 -1.196709E-03 2.812413E+02 1.943912E+04 -1.033912E-03 2.813914E+02 1.942461E+04 -9.307776E-04 2.815415E+02 1.925606E+04 -2.862954E-03 2.816916E+02 1.925833E+04 -2.542702E-03 2.818416E+02 1.905167E+04 -4.995222E-03 2.819917E+02 1.934721E+04 -7.772534E-04 2.821418E+02 1.934046E+04 -5.717553E-04 2.822919E+02 1.927290E+04 -1.179197E-03 2.824420E+02 1.939365E+04 7.336938E-04 2.825921E+02 1.906325E+04 -3.405649E-03 2.827422E+02 1.936355E+04 9.276445E-04 2.828922E+02 1.934524E+04 9.803105E-04 2.830423E+02 1.915943E+04 -1.233555E-03 2.831924E+02 1.918513E+04 -5.902461E-04 2.833425E+02 1.922826E+04 2.925454E-04 2.834926E+02 1.952853E+04 4.682808E-03 2.836427E+02 2.016889E+04 1.373847E-02 2.837928E+02 2.097197E+04 2.506408E-02 2.839428E+02 2.303429E+04 5.372387E-02 2.840929E+02 2.738953E+04 1.140600E-01 2.842430E+02 3.463314E+04 2.145072E-01 2.843931E+02 4.516762E+04 3.609117E-01 2.845432E+02 5.654773E+04 5.197217E-01 2.846933E+02 6.560000E+04 6.469536E-01 2.848434E+02 6.983041E+04 7.076648E-01 2.849934E+02 6.892184E+04 6.969576E-01 2.851435E+02 6.576038E+04 6.546878E-01 2.852936E+02 6.335512E+04 6.228135E-01 2.854437E+02 6.387755E+04 6.319219E-01 2.855938E+02 6.426977E+04 6.392342E-01 2.857439E+02 6.243583E+04 6.151484E-01 2.858940E+02 5.856887E+04 5.621758E-01 2.860440E+02 5.250829E+04 4.778344E-01 2.861941E+02 4.746090E+04 4.074967E-01 2.863442E+02 4.378519E+04 3.563723E-01 2.864943E+02 4.329718E+04 3.505384E-01 2.866444E+02 4.717371E+04 4.071652E-01 2.867945E+02 5.764549E+04 5.587073E-01 2.869445E+02 7.542943E+04 8.161452E-01 2.870946E+02 1.022570E+05 1.205186E+00 2.872447E+02 1.420721E+05 1.783755E+00 2.873948E+02 1.980082E+05 2.598567E+00 2.875449E+02 2.601846E+05 3.507797E+00 2.876950E+02 3.051516E+05 4.170794E+00 2.878451E+02 3.075577E+05 4.215961E+00 2.879951E+02 2.634520E+05 3.581176E+00 2.881452E+02 1.964704E+05 2.608097E+00 2.882953E+02 1.382699E+05 1.759451E+00 2.884454E+02 9.800092E+04 1.170873E+00 2.885955E+02 7.502233E+04 8.347418E-01 2.887456E+02 6.324525E+04 6.627542E-01 2.888957E+02 5.798439E+04 5.865876E-01 2.890457E+02 5.690682E+04 5.722399E-01 2.891958E+02 5.785875E+04 5.880572E-01 2.893459E+02 6.048598E+04 6.289612E-01 2.894960E+02 6.186431E+04 6.513582E-01 2.896461E+02 6.273291E+04 6.662074E-01 2.897962E+02 6.250347E+04 6.646085E-01 2.899463E+02 6.198757E+04 6.586796E-01 2.900963E+02 6.124144E+04 6.492403E-01 2.902464E+02 6.143134E+04 6.539263E-01 2.903965E+02 6.122316E+04 6.525871E-01 2.905466E+02 6.193105E+04 6.651736E-01 2.906967E+02 6.231441E+04 6.728645E-01 2.908468E+02 6.294481E+04 6.843622E-01 2.909969E+02 6.318472E+04 6.899267E-01 2.911469E+02 6.385288E+04 7.020869E-01 2.912970E+02 6.537273E+04 7.274073E-01 2.914471E+02 6.711766E+04 7.563118E-01 2.915972E+02 6.918945E+04 7.903985E-01 2.917473E+02 7.069091E+04 8.157992E-01 2.918974E+02 7.183993E+04 8.358367E-01 2.920475E+02 7.406425E+04 8.727030E-01 2.921975E+02 7.484589E+04 8.872197E-01 2.923476E+02 7.538139E+04 8.979479E-01 2.924977E+02 7.500624E+04 8.944420E-01 2.926478E+02 7.460003E+04 8.904260E-01 2.927979E+02 7.356000E+04 8.764018E-01 2.929480E+02 7.324946E+04 8.738225E-01 2.930981E+02 7.252191E+04 8.646274E-01 2.932481E+02 7.177281E+04 8.550418E-01 2.933982E+02 7.131862E+04 8.500935E-01 2.935483E+02 7.104460E+04 8.479876E-01 2.936984E+02 7.091054E+04 8.481005E-01 2.938485E+02 7.075327E+04 8.478366E-01 2.939986E+02 7.056573E+04 8.470801E-01 2.941487E+02 7.085602E+04 8.539971E-01 2.942987E+02 7.107356E+04 8.597676E-01 2.944488E+02 7.121490E+04 8.643277E-01 2.945989E+02 7.112570E+04 8.651698E-01 2.947490E+02 7.161498E+04 8.753976E-01 2.948991E+02 7.155595E+04 8.767483E-01 2.950492E+02 7.212182E+04 8.882855E-01 2.951992E+02 7.217101E+04 8.914276E-01 2.953493E+02 7.223352E+04 8.947962E-01 2.954994E+02 7.207752E+04 8.945866E-01 2.956495E+02 7.285941E+04 9.098009E-01 2.957996E+02 7.285532E+04 9.121175E-01 2.959497E+02 7.300466E+04 9.169739E-01 2.960998E+02 7.281511E+04 9.162329E-01 2.962498E+02 7.290198E+04 9.200718E-01 2.963999E+02 7.312675E+04 9.262157E-01 2.965500E+02 7.294275E+04 9.255645E-01 2.967001E+02 7.256071E+04 9.215927E-01 2.968502E+02 7.335874E+04 9.373689E-01 2.970003E+02 7.365347E+04 9.447586E-01 2.971504E+02 7.370564E+04 9.480929E-01 2.973004E+02 7.373016E+04 9.509692E-01 2.974505E+02 7.374483E+04 9.536854E-01 2.976006E+02 7.423175E+04 9.644111E-01 2.977507E+02 7.452220E+04 9.718416E-01 2.979008E+02 7.451581E+04 9.742464E-01 2.980509E+02 7.474433E+04 9.806632E-01 2.982010E+02 7.516579E+04 9.904019E-01 2.983510E+02 7.490583E+04 9.884986E-01 2.985011E+02 7.479148E+04 9.890817E-01 2.986512E+02 7.572998E+04 1.007789E+00 2.988013E+02 7.554738E+04 1.007227E+00 2.989514E+02 7.618046E+04 1.020764E+00 2.991015E+02 7.556185E+04 1.012656E+00 2.992516E+02 7.555353E+04 1.015109E+00 2.994016E+02 7.585395E+04 1.022943E+00 2.995517E+02 7.594562E+04 1.027161E+00 2.997018E+02 7.584096E+04 1.027958E+00 2.998519E+02 7.624453E+04 1.037662E+00 3.000020E+02 7.597128E+04 1.035509E+00 3.001521E+02 7.655352E+04 1.048407E+00 3.003022E+02 7.625960E+04 1.045890E+00 3.004522E+02 7.602440E+04 1.044393E+00 3.006023E+02 7.652188E+04 1.055875E+00 3.007524E+02 7.638938E+04 1.056206E+00 3.009025E+02 7.593759E+04 1.050843E+00 3.010526E+02 7.634888E+04 1.060858E+00 3.012027E+02 7.616704E+04 1.060298E+00 3.013528E+02 7.591060E+04 1.058390E+00 3.015028E+02 7.606841E+04 1.063912E+00 3.016529E+02 7.613695E+04 1.067845E+00 3.018030E+02 7.531160E+04 1.055649E+00 3.019531E+02 7.533733E+04 1.058791E+00 3.021032E+02 7.542667E+04 1.063094E+00 3.022533E+02 7.469189E+04 1.052430E+00 3.024034E+02 7.450716E+04 1.051732E+00 3.025534E+02 7.482970E+04 1.060285E+00 3.027035E+02 7.369452E+04 1.042194E+00 3.028536E+02 7.376105E+04 1.046055E+00 3.030037E+02 7.405334E+04 1.054076E+00 3.031538E+02 7.291334E+04 1.035740E+00 3.033039E+02 7.309117E+04 1.041647E+00 3.034539E+02 7.270438E+04 1.037125E+00 3.036040E+02 7.209127E+04 1.028379E+00 3.037541E+02 7.172982E+04 1.024264E+00 3.039042E+02 7.144082E+04 1.021475E+00 3.040543E+02 7.119720E+04 1.019512E+00 3.042044E+02 7.079488E+04 1.014565E+00 3.043545E+02 7.019138E+04 1.005816E+00 3.045045E+02 6.987811E+04 1.002477E+00 3.046546E+02 6.953658E+04 9.985831E-01 3.048047E+02 6.911909E+04 9.932320E-01 3.049548E+02 6.847697E+04 9.835992E-01 3.051049E+02 6.812430E+04 9.794070E-01 3.052550E+02 6.750200E+04 9.700648E-01 3.054051E+02 6.761650E+04 9.747092E-01 3.055551E+02 6.746031E+04 9.742003E-01 3.057052E+02 6.685295E+04 9.650499E-01 3.058553E+02 6.647675E+04 9.602855E-01 3.060054E+02 6.618498E+04 9.571164E-01 3.061555E+02 6.539816E+04 9.443912E-01 3.063056E+02 6.506518E+04 9.403642E-01 3.064557E+02 6.494225E+04 9.403772E-01 3.066057E+02 6.452943E+04 9.347631E-01 3.067558E+02 6.438817E+04 9.343949E-01 3.069059E+02 6.394463E+04 9.281322E-01 3.070560E+02 6.276507E+04 9.074689E-01 3.072061E+02 6.343855E+04 9.229574E-01 3.073562E+02 6.251709E+04 9.072390E-01 3.075063E+02 6.250930E+04 9.093981E-01 3.076563E+02 6.173015E+04 8.963701E-01 3.078064E+02 6.172906E+04 8.986349E-01 3.079565E+02 6.188362E+04 9.039823E-01 3.081066E+02 6.093814E+04 8.875408E-01 3.082567E+02 6.085476E+04 8.881484E-01 3.084068E+02 6.012334E+04 8.758499E-01 3.085569E+02 5.982066E+04 8.720462E-01 3.087069E+02 5.921223E+04 8.621059E-01 3.088570E+02 5.909974E+04 8.620560E-01 3.090071E+02 5.884310E+04 8.591045E-01 3.091572E+02 5.869192E+04 8.582576E-01 3.093073E+02 5.837131E+04 8.539830E-01 3.094574E+02 5.771672E+04 8.429305E-01 3.096075E+02 5.769912E+04 8.447325E-01 3.097575E+02 5.755634E+04 8.439943E-01 3.099076E+02 5.731818E+04 8.413060E-01 3.100577E+02 5.731466E+04 8.433868E-01 3.102078E+02 5.670489E+04 8.330777E-01 3.103579E+02 5.682819E+04 8.377366E-01 3.105080E+02 5.595845E+04 8.220209E-01 3.106581E+02 5.584156E+04 8.217226E-01 3.108081E+02 5.594161E+04 8.258916E-01 3.109582E+02 5.557043E+04 8.203341E-01 3.111083E+02 5.556803E+04 8.223856E-01 3.112584E+02 5.523877E+04 8.176551E-01 3.114085E+02 5.464602E+04 8.074173E-01 3.115586E+02 5.455434E+04 8.075764E-01 3.117086E+02 5.442314E+04 8.069051E-01 3.118587E+02 5.440259E+04 8.085428E-01 3.120088E+02 5.443678E+04 8.113313E-01 3.121589E+02 5.376736E+04 7.993274E-01 3.123090E+02 5.369548E+04 7.998618E-01 3.124591E+02 5.387573E+04 8.057193E-01 3.126092E+02 5.365661E+04 8.031417E-01 3.127592E+02 5.339408E+04 7.996272E-01 3.129093E+02 5.308534E+04 7.951094E-01 3.130594E+02 5.263346E+04 7.875163E-01 3.132095E+02 5.309127E+04 7.993125E-01 3.133596E+02 5.265286E+04 7.919735E-01 3.135097E+02 5.257567E+04 7.923451E-01 3.136598E+02 5.187338E+04 7.792764E-01 3.138098E+02 5.176718E+04 7.789870E-01 3.139599E+02 5.203526E+04 7.867714E-01 3.141100E+02 5.185891E+04 7.849689E-01 3.142601E+02 5.162380E+04 7.818797E-01 3.144102E+02 5.145142E+04 7.801347E-01 3.145603E+02 5.118994E+04 7.764370E-01 3.147104E+02 5.096823E+04 7.735861E-01 3.148604E+02 5.088039E+04 7.736457E-01 3.150105E+02 5.070377E+04 7.717546E-01 3.151606E+02 5.098981E+04 7.800137E-01 3.153107E+02 5.042700E+04 7.696165E-01 3.154608E+02 5.008601E+04 7.640628E-01 3.156109E+02 4.993858E+04 7.627601E-01 3.157610E+02 5.027796E+04 7.722330E-01 3.159110E+02 5.019172E+04 7.722911E-01 3.160611E+02 4.989903E+04 7.677502E-01 3.162112E+02 4.997002E+04 7.712952E-01 3.163613E+02 4.976314E+04 7.686405E-01 3.165114E+02 4.939124E+04 7.622734E-01 3.166615E+02 4.945502E+04 7.656527E-01 3.168116E+02 4.916110E+04 7.609959E-01 3.169616E+02 4.925579E+04 7.650741E-01 3.171117E+02 4.889214E+04 7.588105E-01 3.172618E+02 4.910071E+04 7.654706E-01 3.174119E+02 4.864650E+04 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