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CC=Collection Code: [AB2X4]=ANX Form: [cF56]=Pearson: [e d a]=Wyckoff Symbol: [Al2MgO4]=Structure Type:
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TitleKristallstruktur von K2 Ti (O2) F4 (H2 O).5. Strukturchemischer Vergleich und spektroskopische Daten der Verbindungen K2 Ti (O2) F4 (H2 O)x (mit x = 1, .5, 0).
AuthorsSchmidt, R.;Pausewang, G.
ReferenceZeitschrift fuer Anorganische und Allgem (1988) 559, 135-142
Link XRef SCOPUS Google
CompoundH2 F8 K4 O5 Ti2 - Tetrapotassium di-mue-fluoro-bis(peroxotrifluoro)dititanate hydrate [A2B4XY4Z8] [mS84] [f9 e] []
Cell16.805(6), 6.532(1), 12.243(4), 90., 115.8(1), 90.
C12/C1 (15) V=1209.95
RemarksR=0.043000 : M =O :
The coordinates are those given in the paper but the atomic distances do not agree with those calculated during testing.The coordinates are probably correct.
At least one temperature factor missing in the paper.

Atom (site) Oxid. x, y, z, B, Occupancy
Ti1(8f)4
K1(8f)1
K2(8f)1
F1(8f)-1
F2(8f)-1
F3(8f)-1
F4(8f)-1
O1(8f)-1
O2(8f)-1
O3(4e)-2
H1(8f)1
0.160.160.0301
0.310.25-.3301
0.430.220.3501
0.590.330.3601
0.150.130.5201
0.750.360.6901
0.730.070.5101
0.600.130.5701
0.570.340.5801
00.310.2501.
0.950.420.1701
Atom (site) Oxid. U11, U22, U33, U12, U13, U23
Ti1(8f)4
K1(8f)1
K2(8f)1
F1(8f)-1
F2(8f)-1
F3(8f)-1
F4(8f)-1
O1(8f)-1
O2(8f)-1
O3(4e)-2
H1(8f)1
0.010.010.01-.000.00-.00
0.020.030.02-.000.010.00
0.020.020.02-.000.000.00
0.010.030.01-.000.00-.00
0.020.010.020.000.01-.00
0.010.020.01-.000.000.00
0.020.010.030.000.010.00
0.020.010.03-.000.010.00
0.020.010.020.000.010.00
0.040.080.0700.030
000000

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