American Mineralogist Crystal Structure Database

1 matching records for this search.

H10 N2 O7 P2
 
Averbuch-Pouchot M, Durif A
European Journal of Solid State and Inorganic Chemistry 29 (1992) 191-198
Crystal structure of diammonium-dihydrogeno-diphosphate:
(NH4)2H2P2O7
_cod_database_code 1007205
_database_code_amcsd 0012549
9.058 11.199 7.764 90 108.40 90 P2_1/a
atom      x      y     z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
P1   .70704 .02085 .7665  .0166  .0160  .0181 -.0019  .0082 -.0026
P2   .79628 .00622 .1696  .0136  .0130  .0178  .0002  .0056 -.0003
O1    .8140  .0141 .9714  .0204   .026  .0198  .0048  .0086 -.0010
O2    .5568 -.0559 .7287  .0163   .024   .035 -.0047  .0116 -.0078
O3    .7983 -.0287 .6509  .0212   .037  .0261 -.0074  .0139 -.0140
O4    .6758  .1517 .7582   .033   .018   .028  .0004  .0125  .0031
O5    .6488 -.0535 .1727  .0151   .023   .030 -.0043  .0103 -.0027
O6    .9387 -.0660 .2898  .0172  .0198   .030  .0012  .0024  .0070
O7    .8089  .1373 .2107  .0267  .0138   .022 -.0004  .0084 -.0021
N1   -.0112  .7502 .9678   .025   .019   .031  -.001  .0110   .000
N2    .1499  .7318 .4588   .032   .019   .022   .002   .008   .000
H1     .049   .690  .039
H2     .537   .718  .899
H3     .533   .302  .958
H4     .398   .780  .907
H5     .300   .167    .5
H6     .446   .214  .609
H7     .148   .788  .548
H8     .200   .754  .403
H9     .009   .520  .748
H10    .027   .967  .323
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