Structure 1563512

1563511 << 1563512 >> 1563513
Original COD entry Download CIF Download DOT

Citation: Pizon, David; Henry, Natacha; Loiseau, Thierry; Roussel, Pascal; Abraham, Francis (2010). Synthesis, crystal structure and thermal behavior of two hydrated forms of lanthanide phthalates Ln2(O2+C6H4--CO2)3(H2O) (Ln=Ce, Nd) and Nd2(O2C--C6H4--CO2)3(H2O)3. Journal of Solid State Chemistry, 183, pp. 1943-1948.

Formula: C24 H12 Ce2 O13

Cell parameters:

  • a = 27.5640(4) Å
  • b = 11.4041(2) Å
  • c = 15.5519(2) Å
  • α = 90°
  • β = 90°
  • γ = 90°

List type: interleaving

List: 2D

Combined 3D structure and graph

span 1 {1 1 1}
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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 2

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

Dimensionality: 2

Formula: C96 H48 Ce8 O52 (C24 H12 Ce2 O13)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 4, 3, 3, 4, 12, 19, 33, 42
  • 1, 2, 4, 3, 3, 4, 15, 18, 37, 43
  • 1, 2, 4, 3, 3, 4, 15, 22, 28, 40
  • 1, 2, 4, 3, 3, 4, 16, 25, 40, 49
  • 1, 2, 4, 3, 3, 5, 19, 21, 31, 37
  • 1, 2, 4, 3, 3, 5, 20, 22, 37, 51
  • 1, 2, 4, 5, 5, 12, 19, 33, 42, 71
  • 1, 2, 4, 5, 5, 15, 18, 37, 43, 73
  • 1, 2, 4, 5, 5, 15, 22, 28, 40, 67
  • 1, 2, 4, 5, 5, 16, 25, 40, 49, 75
  • 1, 2, 4, 5, 6, 19, 21, 31, 37, 78
  • 1, 2, 4, 5, 6, 20, 22, 37, 51, 83
  • 1, 7, 9, 24, 21, 49, 44, 76, 66, 95
  • 2, 9, 10, 25, 24, 48, 46, 74, 70, 94
  • 2, 9, 10, 25, 24, 48, 47, 73, 71, 95
  • 2, 9, 11, 31, 26, 52, 46, 87, 73, 107
  • 2, 9, 11, 31, 28, 55, 53, 89, 73, 113
  • 2, 9, 11, 33, 28, 56, 57, 85, 77, 113
  • 2, 10, 11, 28, 28, 53, 49, 90, 71, 104
  • 2, 10, 11, 28, 30, 59, 51, 87, 70, 117
  • 2, 10, 11, 30, 30, 59, 50, 86, 70, 117
  • 3, 4, 3, 3, 4, 12, 19, 33, 42, 71
  • 3, 4, 3, 3, 4, 15, 18, 37, 43, 73
  • 3, 4, 3, 3, 4, 15, 22, 28, 40, 67
  • 3, 4, 3, 3, 4, 16, 25, 40, 49, 75
  • 3, 4, 3, 3, 5, 19, 21, 31, 37, 78
  • 3, 4, 3, 3, 5, 20, 22, 37, 51, 83
  • 3, 4, 5, 5, 12, 19, 33, 42, 71, 78
  • 3, 4, 5, 5, 15, 18, 37, 43, 73, 76
  • 3, 4, 5, 5, 15, 22, 28, 40, 67, 87
  • 3, 4, 5, 5, 16, 25, 40, 49, 75, 86
  • 3, 4, 5, 6, 19, 21, 31, 37, 78, 81
  • 3, 4, 5, 6, 20, 22, 37, 51, 83, 83
  • 3, 4, 16, 15, 29, 32, 61, 64, 87, 78
  • 3, 4, 18, 15, 27, 31, 61, 62, 85, 86
  • 3, 4, 19, 18, 38, 36, 74, 61, 103, 83
  • 3, 4, 19, 18, 39, 41, 73, 65, 103, 93
  • 3, 5, 23, 19, 34, 31, 78, 65, 98, 79
  • 3, 5, 24, 19, 33, 38, 79, 74, 91, 85
  • 3, 6, 7, 13, 19, 33, 42, 71, 78, 90
  • 3, 6, 7, 16, 18, 37, 43, 73, 76, 99
  • 3, 6, 7, 16, 22, 28, 40, 67, 87, 89
  • 3, 6, 7, 17, 25, 40, 49, 75, 86, 105
  • 3, 6, 8, 20, 21, 31, 37, 78, 81, 94
  • 3, 6, 8, 21, 22, 37, 51, 83, 83, 98
  • 3, 14, 14, 31, 29, 63, 55, 88, 73, 106
  • 3, 15, 14, 30, 29, 63, 55, 88, 73, 106
  • 3, 15, 14, 32, 29, 64, 59, 85, 78, 104
  • 3, 16, 14, 29, 29, 63, 55, 88, 72, 107
  • 8, 9, 24, 21, 49, 44, 76, 66, 95, 86
  • 9, 9, 22, 23, 50, 44, 76, 63, 97, 90
span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

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

Dimensionality: 2

Formula: C96 H48 Ce8 O52 (C24 H12 Ce2 O13)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 4, 3, 3, 4, 12, 19, 33, 42
  • 1, 2, 4, 3, 3, 4, 15, 18, 37, 43
  • 1, 2, 4, 3, 3, 4, 15, 22, 28, 40
  • 1, 2, 4, 3, 3, 4, 16, 25, 40, 49
  • 1, 2, 4, 3, 3, 5, 19, 21, 31, 37
  • 1, 2, 4, 3, 3, 5, 20, 22, 37, 51
  • 1, 2, 4, 5, 5, 12, 19, 33, 42, 71
  • 1, 2, 4, 5, 5, 15, 18, 37, 43, 73
  • 1, 2, 4, 5, 5, 15, 22, 28, 40, 67
  • 1, 2, 4, 5, 5, 16, 25, 40, 49, 75
  • 1, 2, 4, 5, 6, 19, 21, 31, 37, 78
  • 1, 2, 4, 5, 6, 20, 22, 37, 51, 83
  • 1, 7, 9, 24, 21, 49, 44, 76, 66, 95
  • 2, 9, 10, 25, 24, 48, 46, 74, 70, 94
  • 2, 9, 10, 25, 24, 48, 47, 73, 71, 95
  • 2, 9, 11, 31, 26, 52, 46, 87, 73, 107
  • 2, 9, 11, 31, 28, 55, 53, 89, 73, 113
  • 2, 9, 11, 33, 28, 56, 57, 85, 77, 113
  • 2, 10, 11, 28, 28, 53, 49, 90, 71, 104
  • 2, 10, 11, 28, 30, 59, 51, 87, 70, 117
  • 2, 10, 11, 30, 30, 59, 50, 86, 70, 117
  • 3, 4, 3, 3, 4, 12, 19, 33, 42, 71
  • 3, 4, 3, 3, 4, 15, 18, 37, 43, 73
  • 3, 4, 3, 3, 4, 15, 22, 28, 40, 67
  • 3, 4, 3, 3, 4, 16, 25, 40, 49, 75
  • 3, 4, 3, 3, 5, 19, 21, 31, 37, 78
  • 3, 4, 3, 3, 5, 20, 22, 37, 51, 83
  • 3, 4, 5, 5, 12, 19, 33, 42, 71, 78
  • 3, 4, 5, 5, 15, 18, 37, 43, 73, 76
  • 3, 4, 5, 5, 15, 22, 28, 40, 67, 87
  • 3, 4, 5, 5, 16, 25, 40, 49, 75, 86
  • 3, 4, 5, 6, 19, 21, 31, 37, 78, 81
  • 3, 4, 5, 6, 20, 22, 37, 51, 83, 83
  • 3, 4, 16, 15, 29, 32, 61, 64, 87, 78
  • 3, 4, 18, 15, 27, 31, 61, 62, 85, 86
  • 3, 4, 19, 18, 38, 36, 74, 61, 103, 83
  • 3, 4, 19, 18, 39, 41, 73, 65, 103, 93
  • 3, 5, 23, 19, 34, 31, 78, 65, 98, 79
  • 3, 5, 24, 19, 33, 38, 79, 74, 91, 85
  • 3, 6, 7, 13, 19, 33, 42, 71, 78, 90
  • 3, 6, 7, 16, 18, 37, 43, 73, 76, 99
  • 3, 6, 7, 16, 22, 28, 40, 67, 87, 89
  • 3, 6, 7, 17, 25, 40, 49, 75, 86, 105
  • 3, 6, 8, 20, 21, 31, 37, 78, 81, 94
  • 3, 6, 8, 21, 22, 37, 51, 83, 83, 98
  • 3, 14, 14, 31, 29, 63, 55, 88, 73, 106
  • 3, 15, 14, 30, 29, 63, 55, 88, 73, 106
  • 3, 15, 14, 32, 29, 64, 59, 85, 78, 104
  • 3, 16, 14, 29, 29, 63, 55, 88, 72, 107
  • 8, 9, 24, 21, 49, 44, 76, 66, 95, 86
  • 9, 9, 22, 23, 50, 44, 76, 63, 97, 90
span 1 {1 1 1}