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ICSD for WWW : Details

ICSD for WWW

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CC=Collection Code: [AB2X4]=ANX Form: [cF56]=Pearson: [e d a]=Wyckoff Symbol: [Al2MgO4]=Structure Type:
***Click the ANX, Pearson or Wyckoff Symbol to find structures with that symbol***.
CC=56872 Help
TitleThe crystal structure of K2 (Cu (Te O4 (O H)2)) . H2 O.
AuthorsEffenberger, H.;Tillmanns, E.
ReferenceZeitschrift fuer Kristallographie (1993) 205, 41-53
Link XRef SCOPUS SCIRUS Google
CompoundH4 Cu1 K2 O7 Te1 - Dipotassium catena-dihydroxotetraoxotelluratocuprate hydrate [ABC2X7] [mS60] [f4 e c a] []
Cell9.589(2), 6.235(1), 12.014(3), 90., 90.44(2), 90.
C12/C1 (15) V=718.26
RemarksPDF =81-1845 :
Calculated density unusual but tolerable.
No R value given in the paper.
Averaged data of 73259 in C1c1
PDF 81-1845, hydrogen bonds violate sp. gr. Cccm

Atom (site) Oxid. x, y, z, B, Occupancy
K1(8f)1
Cu1(4a)2
Te1(4c)6
O1(8f)-2
O2(8f)-2
O3(8f)-2
O4(4e)-2
H1(8*)1
0.3187(2)0.2300(2)0.3141(2)01
00001
0.250.25001
0.1240(5)0.1397(5)0.1085(4)01
0.1314(5)0.1166(5)0.8935(4)01
0.3566(4)-.0237(5)0.0116(4)01.
00.3956(5)0.2501.
02.
Atom (site) Oxid. U11, U22, U33, U12, U13, U23
K1(8f)1
Cu1(4a)2
Te1(4c)6
O1(8f)-2
O2(8f)-2
O3(8f)-2
O4(4e)-2
H1(8*)1
0.0428(9)0.0201(3)0.0233(6)-0.0010(5)-0.0019(6)0.0023(5)
0.0114(1)0.0156(1)0.0174(1)-0.0052(1)-0.0005(1)0.0002(1)
0.0100(1)0.0118(1)0.0145(1)-0.0036(1)0.0003(1)-0.0006(1)
0.0152(15)0.0187(10)0.0177(16)-0.0058(10)0.0011(12)-0.0008(11)
0.0154(14)0.0193(10)0.0167(16)-0.0067(9)-0.0010(11)-0.0009(12)
0.0193(18)0.0163(9)0.0287(21)0.0008(9)-0.0012(14)-0.0012(12)
0.0356(23)0.0229(10)0.0275(18)00.0059(13)0
000000

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