Accuracy

rhodium(i) fluoride   5129 Rhodium(I) fluoride

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    #  Species Formula
  5119 Rhodium tetracarbonyl, anion (Geo)C4O4Rh
  5120 Rhodium tetracarbonyl, anionC4O4Rh
  5121 Rh(III)N6 (GOYRER) (Geo)C24H16N6O4Rh
  5122 Rhodium pentacarbonyl, cation (Geo)C5O5Rh
  5123 Rhodium pentacarbonyl, cationC5O5Rh
  5124 Rhodium(III) hexaquo (Geo)H12O6Rh
  5125 Rh(II)(H2O)6H12O6Rh
  5126 Rh(II)(H2O)6 (Geo)H12O6Rh
  5127 Rh(III)O6(3-) (CAZCIP) (Geo)C6O12Rh
  5128 Rhodium(I) fluoride (Geo)FRh
  5129 Rhodium(I) fluoride FRh
  5130 Rh(III)P3C3 (KIJSEB) (Geo)C12H36P3Rh
  5131 Rh(III)P3C3 (TOXBEN) (Geo)C14H36P3Rh
  5132 Rhodium sulfideSRh
  5133 Rhodium sulfide (Geo)SRh
  5134 Rh(III)C3N2S (KIJSAX)C13H33N2SRh
  5135 Rh(III)N3S3(3+) (SCRHCL) (Geo)C3H15N9S3Rh
  5136 Rh(III)N3S3(3+) (SCRHCL)C3H15N9S3Rh
  5137 Rhodium(i) chloride (Geo)ClRh
  5138 Rhodium(i) chlorideClRh
  5139 Rh(I)C8Cl (DBURHC10) (Geo)C8H12ClRh


ΔHf: 77.7 kcal/mol,     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.
Dipole: 4.0 Debye,     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.
I.P.: 4.8 eV,     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.
  
 PULAY SHIFT=80 UHF PM7
Rhodium(I) fluoride
 I=4.777 IR=PW91D D=4.004 DR=PW91D H=77.7 HR=PW91D
 Rh     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  F     1.93227466 +1    0.0000000 +0    0.0000000 +0     1     0     0