Information card for entry 4300371

Structure parameters

• Formula: C40 H36 Cl2 Mn2 N24 O8
• Calculated formula: C40 H36 Cl2 Mn2 N24 O8
• SMILES: C1N2Cn3ccc[n]3[Mn]3([n]4cccn14)([n]1n(C2)ccc1)([N]#CC)[N]#CC(=C(C#N)C#[N][Mn]12([n]4cccn4CN(Cn4ccc[n]14)Cn1[n]2ccc1)([N]#CC)[N]#CC(=C(C#[N]3)C#N)C#N)C#N.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O
• Title of publication: Coordination complexes with cis-TCNE Radical Anion ligands. Models of M[TCNE]~2~ Magnets.
• Authors of publication: Wang, Guangbin; Zhu, Huifang; Fan, Jian; Slebodnick, Carla; Yee, Gordon T.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• a: 16.716 ± 0.003 Å
• b: 21.084 ± 0.003 Å
• c: 16.669 ± 0.002 Å
• α: 90°
• β: 117.862 ± 0.018°
• γ: 90°
• Cell volume: 5193.9 ± 1.5 ų
• Cell temperature: 283 ± 2 K
• Ambient diffraction temperature: 283 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No