Structure 7211854

7211853 << 7211854 >> 7211855

Citation: Hao, Zheng-Ming; Wang, Jun; Zhang, Xian-Ming (2010). Red phosphorescent cuprous halide/pseudohalide coordination polymers with pyrimidine-2-thionates as Co-ligands. CrystEngComm, 12, pp. 1103-.

Formula: C9 H6 Cu3 N5 S3

Cell parameters:

a = 10.764(3) Å
b = 7.732(2) Å
c = 16.538(4) Å

α = 90.00°
β = 101.929(5)°
γ = 90.00°

List type: interleaving

List: 2D

Combined 3D structure and graph

JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 2

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

Dimensionality: 2

Formula: C18 H12 Cu6 N10 S6 (C9 H6 Cu3 N5 S3)

Multiplicity: 1

Coordination sequences:

1, 2, 3, 3, 3, 6, 8, 16, 21, 29
1, 2, 4, 2, 5, 7, 11, 19, 26, 34
1, 2, 4, 3, 10, 13, 17, 28, 36, 46
1, 2, 4, 7, 7, 11, 19, 26, 34, 41
1, 2, 4, 7, 9, 15, 22, 23, 33, 48
1, 2, 4, 8, 8, 12, 20, 33, 39, 48
2, 3, 11, 17, 24, 37, 46, 43, 47, 58
2, 4, 5, 7, 8, 16, 21, 29, 39, 46
2, 6, 10, 16, 26, 38, 42, 47, 49, 59
3, 3, 3, 3, 6, 8, 16, 21, 29, 39
3, 4, 2, 5, 7, 11, 19, 26, 34, 41
3, 4, 3, 10, 13, 17, 28, 36, 46, 58
3, 4, 7, 7, 11, 19, 26, 34, 41, 53
3, 4, 7, 9, 15, 22, 23, 33, 48, 57
3, 4, 8, 8, 12, 20, 33, 39, 48, 60
3, 5, 9, 9, 16, 21, 29, 39, 46, 60
3, 6, 13, 15, 19, 26, 38, 47, 60, 76
3, 7, 10, 19, 28, 35, 43, 48, 53, 66
3, 8, 9, 12, 19, 26, 34, 41, 53, 67
3, 8, 10, 16, 19, 28, 36, 47, 58, 67
3, 8, 11, 16, 22, 23, 33, 48, 57, 77
3, 9, 10, 13, 20, 33, 39, 48, 60, 68
3, 10, 16, 19, 23, 30, 40, 54, 67, 80
5, 10, 14, 21, 23, 30, 43, 52, 67, 81
5, 10, 14, 21, 27, 34, 41, 53, 67, 75
6, 9, 11, 19, 30, 34, 43, 52, 60, 68

span 1 {1 1 1}

highlight edges

CIF datablock 1, entity 2 of 2