Accuracy

Re(V)O5(-) (HEFYAS) r   7441 Re(V)O5(-) (HEFYAS) (Geo)

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    #  Species Formula
  7431 Re(C5H5)(CO)3C8H5O3Re
  7432 Re(C5H5)(CO)3 (Geo)C8H5O3Re
  7433 Re(Cp)(CO)3 (COCPRE) (Geo)C8H5O3Re
  7434 Re(Cp)(CO)3 (COCPRE)C8H5O3Re
  7435 ReC6(CO)3(+) (CIZNUU) (Geo)C12H12O3Re
  7436 ReC6(CO)3(+) (CIZNUU)C12H12O3Re
  7437 Re(VII)O4(-) (AMOGOY) (Geo)O4Re
  7438 Re(VII)O4(-) (AMOGOY)O4Re
  7439 Rhenium pentacarbonyl, anion (Geo)C5O5Re
  7440 Rhenium pentacarbonyl, anionC5O5Re
  7441 Re(V)O5(-) (HEFYAS) (Geo) C12H8O5Re
  7442 Re(V)O5(-) (HEFYAS)C12H8O5Re
  7443 Re(IV)(H2O)6 d3 (Geo)H12O6Re
  7444 Re(II)(H2O)6 d5 (Geo)H12O6Re
  7445 Re(II)(H2O)6 2TgH12O6Re
  7446 Re(II)(H2O)6H12O6Re
  7447 Re(II)(H2O)6 (Geo)H12O6Re
  7448 Re(CO)6(+) (FUZJOZ) (Geo)C6O6Re
  7449 Re(CO)6(+) (FUZJOZ)C6O6Re
  7450 Rhenium hexacarbonyl, cation (Geo)C6O6Re
  7451 Rhenium hexacarbonyl, cationC6O6Re


REF: The Cambridge Structural Database: a quarter of a million crystal structures and rising. F. H. Allen, Acta Cryst. B58, 380-388, (2002)
  
 CHARGE=-1 UHF PM7
Re(V)O5(-) (HEFYAS)
 <Re-O> <Re-O><O-Re-O> GR=CCDC
 Re     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     1.66595600 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     1.96190900 +1  111.0326270 +1    0.0000000 +0     1     2     0
  O     2.03838092 +1  115.9358882 +1   86.6897382 +1     1     2     3
  C     1.33961715 +1  112.2764686 +1 -102.2247002 +1     3     1     2
  C     1.37981898 +1  122.7200204 +1  170.5839859 +1     5     3     1
  C     1.40637374 +1  118.6506843 +1  179.1511133 +1     6     5     3
  C     1.32837417 +1  111.7222762 +1  103.9768849 +1     4     1     2
  C     1.38186897 +1  122.7393489 +1 -168.9335198 +1     8     4     1
  C     1.40610327 +1  118.8423988 +1 -179.1693909 +1     9     8     4
  O     2.04324245 +1  115.0501228 +1 -177.9659631 +1     1     2     4
  O     2.04686924 +1  118.8697354 +1  -88.8865809 +1     1     2    11
  C     1.32767663 +1  109.8585136 +1   98.2766196 +1    11     1     2
  C     1.38564287 +1  120.8047918 +1   -0.0543773 +1     7     6     5
  C     1.32498745 +1  111.6430346 +1 -101.0087426 +1    12     1     2
  C     1.38502937 +1  120.8593127 +1   -0.0596735 +1    10     9     8
  C     1.40499888 +1  121.0181009 +1    0.0668522 +1    14     7     6
  C     1.40570035 +1  120.9015854 +1   -0.0227413 +1    16    10     9
  H     1.08278187 +1  120.3060129 +1 -179.7299895 +1     6     5     7
  H     1.08328362 +1  119.0419426 +1 -179.8780001 +1     7     6    14
  H     1.08228584 +1  120.1801104 +1  179.5649131 +1     9     8    10
  H     1.08339720 +1  118.9912256 +1  179.9000279 +1    10     9    16
  H     1.08412382 +1  120.0223265 +1 -179.8723550 +1    14     7    17
  H     1.08360805 +1  120.1137062 +1  179.9255094 +1    16    10    18
  H     1.08229542 +1  121.0861289 +1 -179.5757362 +1    17    14     7
  H     1.08213496 +1  121.0222157 +1  179.6849142 +1    18    16    10