Structure 7211380

7211379 << 7211380 >> 7211389

Citation: Bia\/lo\'nska, Agata; Drabent, Krzysztof; Filipowicz, Barbara; Siczek, Mi\/losz (2013). Reversible guest vapour sorption in breathing crystals of a discrete ionic binuclear Cu(i) complex. CrystEngComm, 15, pp. 9859-.

Formula: C41.23 H48.96 Cl6 Cu2 N16 O13.22

Chemical name: bis(\m~2~-4-(E)-(4-chlorobenzylidene)amino-4H-1,2,4-triazole)-bis((E)-4-(chlorobenzylidene)amino-4H-1,2,4-triazole)-di-copper(i) diperchlorate methanol 5.24-solvate

Cell parameters:

a = 6.955(2) Å
b = 18.182(3) Å
c = 22.181(3) Å

α = 90°
β = 95.31(3)°
γ = 90°

List type: interleaving

List: 1D

Molecules

CIF datablock 2, entity 3 of 4

Basis: (1;0;0)

Dimensionality: 1

Formula: C12 O12 (C O)

Multiplicity: 1

Coordination sequences:

2, 7, 3, 2, 6, 5, 6, 3, 2, 4
2, 8, 9, 4, 4, 3, 6, 9, 3, 2
3, 5, 6, 8, 3, 6, 9, 4, 6, 3
3, 6, 5, 8, 3, 6, 9, 4, 6, 3
4, 3, 4, 6, 7, 4, 10, 4, 4, 5
4, 4, 6, 8, 3, 6, 9, 4, 6, 3
4, 4, 8, 7, 2, 6, 9, 5, 3, 4
4, 5, 10, 4, 2, 4, 8, 9, 2, 4
4, 7, 5, 3, 6, 5, 4, 2, 6, 9
4, 10, 4, 4, 5, 4, 4, 6, 7, 4
5, 3, 4, 6, 9, 8, 5, 3, 6, 5
5, 4, 2, 2, 8, 13, 3, 4, 5, 6
5, 5, 2, 4, 12, 8, 2, 6, 5, 6
5, 6, 2, 4, 5, 6, 5, 2, 2, 8
5, 7, 2, 6, 5, 6, 3, 2, 4, 12
6, 4, 2, 6, 9, 8, 5, 3, 6, 5
6, 5, 2, 4, 5, 6, 5, 2, 2, 8
6, 7, 4, 5, 6, 5, 2, 2, 8, 13
6, 7, 4, 6, 5, 4, 3, 4, 8, 7
8, 4, 2, 6, 5, 6, 3, 2, 4, 12
10, 3, 4, 5, 6, 5, 2, 2, 8, 13

span 1 {1 1 1}

highlight edges

CIF datablock 3, entity 4 of 4

Basis: (1;0;0)

Dimensionality: 1

Formula: C12 O12 (C O)

Multiplicity: 1

Coordination sequences:

2, 7, 3, 2, 6, 5, 6, 3, 2, 4
2, 8, 9, 4, 4, 3, 6, 9, 3, 2
3, 5, 6, 8, 3, 6, 9, 4, 6, 3
3, 6, 5, 8, 3, 6, 9, 4, 6, 3
4, 3, 4, 6, 7, 4, 10, 4, 4, 5
4, 4, 6, 8, 3, 6, 9, 4, 6, 3
4, 4, 8, 7, 2, 6, 9, 5, 3, 4
4, 5, 10, 4, 2, 4, 8, 9, 2, 4
4, 7, 5, 3, 6, 5, 4, 2, 6, 9
4, 10, 4, 4, 5, 4, 4, 6, 7, 4
5, 3, 4, 6, 9, 8, 5, 3, 6, 5
5, 4, 2, 2, 8, 13, 3, 4, 5, 6
5, 5, 2, 4, 12, 8, 2, 6, 5, 6
5, 6, 2, 4, 5, 6, 5, 2, 2, 8
5, 7, 2, 6, 5, 6, 3, 2, 4, 12
6, 4, 2, 6, 9, 8, 5, 3, 6, 5
6, 5, 2, 4, 5, 6, 5, 2, 2, 8
6, 7, 4, 5, 6, 5, 2, 2, 8, 13
6, 7, 4, 6, 5, 4, 3, 4, 8, 7
8, 4, 2, 6, 5, 6, 3, 2, 4, 12
10, 3, 4, 5, 6, 5, 2, 2, 8, 13

span 1 {1 1 1}

highlight edges

CIF datablock 4, entity 5 of 4

Basis: (1;0;0)

Dimensionality: 1

Formula: C12 O12 (C O)

Multiplicity: 1

Coordination sequences:

2, 7, 3, 2, 6, 5, 6, 3, 2, 4
2, 8, 9, 4, 4, 3, 6, 9, 3, 2
3, 5, 6, 8, 3, 6, 9, 4, 6, 3
3, 6, 5, 8, 3, 6, 9, 4, 6, 3
4, 3, 4, 6, 7, 4, 10, 4, 4, 5
4, 4, 6, 8, 3, 6, 9, 4, 6, 3
4, 4, 8, 7, 2, 6, 9, 5, 3, 4
4, 5, 10, 4, 2, 4, 8, 9, 2, 4
4, 7, 5, 3, 6, 5, 4, 2, 6, 9
4, 10, 4, 4, 5, 4, 4, 6, 7, 4
5, 3, 4, 6, 9, 8, 5, 3, 6, 5
5, 4, 2, 2, 8, 13, 3, 4, 5, 6
5, 5, 2, 4, 12, 8, 2, 6, 5, 6
5, 6, 2, 4, 5, 6, 5, 2, 2, 8
5, 7, 2, 6, 5, 6, 3, 2, 4, 12
6, 4, 2, 6, 9, 8, 5, 3, 6, 5
6, 5, 2, 4, 5, 6, 5, 2, 2, 8
6, 7, 4, 5, 6, 5, 2, 2, 8, 13
6, 7, 4, 6, 5, 4, 3, 4, 8, 7
8, 4, 2, 6, 5, 6, 3, 2, 4, 12
10, 3, 4, 5, 6, 5, 2, 2, 8, 13

span 1 {1 1 1}

highlight edges

CIF datablock 5, entity 6 of 4

Basis: (1;0;0)

Dimensionality: 1

Formula: C12 O12 (C O)

Multiplicity: 1

Coordination sequences:

2, 7, 3, 2, 6, 5, 6, 3, 2, 4
2, 8, 9, 4, 4, 3, 6, 9, 3, 2
3, 5, 6, 8, 3, 6, 9, 4, 6, 3
3, 6, 5, 8, 3, 6, 9, 4, 6, 3
4, 3, 4, 6, 7, 4, 10, 4, 4, 5
4, 4, 6, 8, 3, 6, 9, 4, 6, 3
4, 4, 8, 7, 2, 6, 9, 5, 3, 4
4, 5, 10, 4, 2, 4, 8, 9, 2, 4
4, 7, 5, 3, 6, 5, 4, 2, 6, 9
4, 10, 4, 4, 5, 4, 4, 6, 7, 4
5, 3, 4, 6, 9, 8, 5, 3, 6, 5
5, 4, 2, 2, 8, 13, 3, 4, 5, 6
5, 5, 2, 4, 12, 8, 2, 6, 5, 6
5, 6, 2, 4, 5, 6, 5, 2, 2, 8
5, 7, 2, 6, 5, 6, 3, 2, 4, 12
6, 4, 2, 6, 9, 8, 5, 3, 6, 5
6, 5, 2, 4, 5, 6, 5, 2, 2, 8
6, 7, 4, 5, 6, 5, 2, 2, 8, 13
6, 7, 4, 6, 5, 4, 3, 4, 8, 7
8, 4, 2, 6, 5, 6, 3, 2, 4, 12
10, 3, 4, 5, 6, 5, 2, 2, 8, 13

span 1 {1 1 1}

highlight edges

Structure 7211380

Cell parameters:

Combined 3D structure and graph

JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 2, entity 3 of 4

CIF datablock 3, entity 4 of 4

CIF datablock 4, entity 5 of 4

CIF datablock 5, entity 6 of 4