Structure 7107573

7107572 << 7107573 >> 7107588
Original COD entry Download CIF Download DOT

Citation: Qiang Gao; Xiqu Wang; Allan J. Jacobson (2012). A homochiral diamond framework constructed from Fe(III) and Mn(II) oxo-clusters supported by Sb(III) tartrate scaffolds. Chem.Commun., 48, pp. 3990-.

Formula: C49 H53 Fe4 Mn3 N4 O54.5 Sb6

Cell parameters:

  • a = 20.0376(18) Å
  • b = 20.8740(19) Å
  • c = 20.9807(19) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 90.00°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

span 1 {1 1 1}
Ctrl-click to select multiple nodes

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: C96 H48 Fe16 Mn12 O180 Sb24 (C24 H12 Fe4 Mn3 O45 Sb6)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 4, 5, 8, 17, 18, 28, 15, 16
  • 1, 2, 4, 5, 8, 17, 18, 28, 16, 18
  • 1, 2, 4, 8, 11, 18, 21, 27, 34, 32
  • 1, 2, 4, 8, 11, 19, 20, 24, 20, 21
  • 1, 2, 4, 8, 11, 19, 20, 25, 21, 19
  • 1, 2, 4, 8, 12, 18, 19, 23, 19, 21
  • 1, 2, 4, 8, 12, 18, 21, 27, 37, 37
  • 1, 2, 4, 8, 12, 19, 19, 21, 17, 21
  • 1, 2, 5, 7, 9, 19, 22, 28, 18, 28
  • 1, 2, 5, 7, 9, 19, 23, 30, 18, 28
  • 1, 3, 6, 6, 10, 16, 24, 24, 16, 21
  • 1, 3, 6, 6, 10, 16, 24, 25, 18, 20
  • 1, 3, 6, 6, 11, 17, 23, 24, 16, 19
  • 1, 3, 6, 6, 11, 17, 24, 22, 14, 19
  • 1, 3, 6, 7, 13, 21, 40, 38, 33, 26
  • 1, 3, 6, 7, 14, 22, 40, 38, 35, 32
  • 1, 3, 6, 19, 18, 24, 22, 39, 34, 53
  • 1, 3, 7, 9, 11, 23, 22, 23, 20, 29
  • 1, 3, 7, 9, 11, 23, 23, 25, 19, 27
  • 1, 3, 7, 9, 11, 23, 24, 38, 30, 36
  • 1, 3, 7, 10, 12, 22, 21, 23, 18, 29
  • 1, 3, 7, 10, 12, 23, 20, 20, 18, 29
  • 1, 3, 7, 10, 12, 23, 24, 40, 36, 54
  • 2, 5, 6, 16, 17, 25, 16, 18, 16, 34
  • 2, 5, 6, 16, 18, 26, 15, 17, 16, 34
  • 2, 5, 7, 19, 24, 45, 31, 36, 24, 29
  • 2, 5, 10, 24, 25, 39, 31, 40, 21, 26
  • 2, 5, 11, 26, 25, 39, 32, 37, 19, 24
  • 2, 6, 8, 17, 17, 26, 17, 16, 17, 37
  • 2, 6, 8, 17, 18, 26, 16, 17, 18, 35
  • 2, 6, 8, 18, 21, 31, 33, 29, 34, 32
  • 2, 6, 9, 17, 16, 27, 18, 17, 17, 44
  • 2, 6, 9, 17, 16, 27, 19, 19, 17, 43
  • 2, 6, 9, 18, 19, 31, 33, 29, 32, 29
  • 2, 7, 9, 20, 18, 22, 18, 22, 21, 57
  • 2, 7, 9, 20, 18, 23, 20, 25, 34, 55
  • 2, 7, 9, 21, 17, 23, 19, 23, 34, 55
  • 2, 7, 9, 21, 18, 21, 17, 20, 21, 57
  • 2, 7, 9, 22, 18, 23, 20, 21, 18, 40
  • 3, 4, 5, 8, 17, 18, 28, 15, 16, 20
  • 3, 4, 5, 8, 17, 18, 28, 16, 18, 19
  • 3, 4, 8, 11, 18, 21, 27, 34, 32, 38
  • 3, 4, 8, 11, 19, 20, 24, 20, 21, 27
  • 3, 4, 8, 11, 19, 20, 25, 21, 19, 27
  • 3, 4, 8, 12, 18, 19, 23, 19, 21, 31
  • 3, 4, 8, 12, 18, 21, 27, 37, 37, 51
  • 3, 4, 8, 12, 19, 19, 21, 17, 21, 31
  • 3, 5, 7, 9, 19, 22, 28, 18, 28, 29
  • 3, 5, 7, 9, 19, 23, 30, 18, 28, 29
  • 3, 5, 8, 14, 36, 34, 48, 26, 27, 24
  • 3, 6, 10, 14, 36, 35, 45, 25, 27, 23
  • 3, 8, 9, 22, 23, 28, 18, 28, 29, 55
  • 3, 8, 9, 22, 24, 30, 18, 28, 29, 50
  • 3, 8, 9, 23, 25, 42, 28, 35, 29, 45
  • 3, 9, 11, 25, 19, 26, 18, 31, 30, 47
  • 3, 9, 12, 26, 18, 25, 17, 29, 31, 49
  • 3, 11, 13, 22, 18, 23, 19, 34, 36, 65
  • 3, 11, 13, 24, 18, 25, 25, 52, 46, 66
  • 3, 11, 14, 25, 21, 24, 20, 29, 27, 49
  • 3, 11, 14, 25, 22, 26, 19, 27, 28, 46
  • 3, 11, 14, 26, 20, 24, 18, 30, 34, 66
  • 3, 11, 14, 27, 19, 21, 18, 30, 34, 71
  • 3, 12, 15, 30, 20, 18, 7, 13, 25, 62
  • 3, 12, 15, 30, 20, 18, 8, 15, 24, 60
  • 3, 12, 15, 30, 21, 20, 11, 18, 28, 72
  • 3, 12, 15, 30, 21, 21, 12, 29, 36, 65
  • 3, 12, 15, 30, 21, 21, 13, 31, 35, 63
  • 4, 6, 6, 10, 16, 24, 24, 16, 21, 31
  • 4, 6, 6, 10, 16, 24, 25, 18, 20, 29
  • 4, 6, 6, 11, 17, 23, 24, 16, 19, 30
  • 4, 6, 6, 11, 17, 24, 22, 14, 19, 31
  • 4, 6, 7, 13, 21, 40, 38, 33, 26, 27
  • 4, 6, 7, 14, 22, 40, 38, 35, 32, 44
  • 4, 6, 16, 18, 27, 16, 18, 16, 34, 39
  • 4, 6, 16, 19, 28, 15, 17, 16, 34, 39
  • 4, 6, 16, 20, 31, 20, 33, 27, 37, 36
  • 4, 6, 19, 18, 24, 22, 39, 34, 53, 47
  • 4, 7, 9, 11, 23, 22, 23, 20, 29, 29
  • 4, 7, 9, 11, 23, 23, 25, 19, 27, 30
  • 4, 7, 9, 11, 23, 24, 38, 30, 36, 33
  • 4, 7, 10, 12, 22, 21, 23, 18, 29, 34
  • 4, 7, 10, 12, 23, 20, 20, 18, 29, 34
  • 4, 7, 10, 12, 23, 24, 40, 36, 54, 43
  • 4, 7, 18, 17, 28, 18, 19, 16, 41, 45
  • 4, 7, 18, 17, 28, 19, 21, 16, 41, 45
  • 4, 7, 18, 18, 30, 20, 33, 27, 37, 36
  • 4, 7, 21, 21, 27, 22, 31, 26, 39, 32
  • 4, 7, 21, 22, 29, 22, 31, 26, 34, 31
  • 6, 9, 20, 19, 24, 18, 22, 21, 57, 56
  • 6, 9, 21, 19, 23, 17, 20, 21, 57, 56
  • 6, 9, 22, 20, 24, 20, 21, 18, 40, 47
  • 6, 9, 26, 27, 27, 4, 10, 21, 50, 50
span 1 {1 1 1}