Structure 1000022

1000017 << 1000022 >> 1000023
Original COD entry Download CIF Download DOT

Citation: Beran, A; Libowitzky, E; Armbruster, T (1996). A single-crystal infrared spectroscopic and X-ray diffraction study of untwinned San Benito perovskite containing O H groups. Canadian Mineralogist, 34, pp. 803-809.

Formula: Ca O3 Ti

Chemical name: Calcium titanate

Cell parameters:

  • a = 5.380(1) Å
  • b = 5.440(1) Å
  • c = 7.639(1) Å
  • α = 90°
  • β = 90°
  • γ = 90°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 1

Basis: (1;0;0 0;1;0 0;0;1)

Dimensionality: 3

Formula: O12 Ti4 (O3 Ti)

Multiplicity: 1

Coordination sequences:

  • 2, 10, 10, 46, 26, 106, 50, 190, 82, 298
  • 6, 6, 30, 18, 78, 38, 150, 66, 246, 102
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