Information card for entry 2010373

Structure parameters

• Formula: C48 H38 Cl4 F6 Mn N5 O5 P6
• Calculated formula: C48 H38 Cl4 F6 Mn N5 O5 P6
• SMILES: [Mn]1([P](Oc2ccccc2)(Oc2ccccc2)Oc2ccccc2)([P](P2(=NP(Cl)(Cl)=NP(Cl)(Cl)=N2)c2ccccc2)(c2ccccc2)c2ccccc2)([n]2c(cccc2)c2[n]1cccc2)(C#[O])C#[O].[P](F)(F)(F)(F)(F)[F-]
• Title of publication: cis-trans-[{N~3~P~3~Cl~4~(C~6~H~5~)(PPh~2~)}Mn(CO)~2~(bipy) {P(OPh)~3~}]PF~6~. A Cationic Manganese–Carbonyl Complex with a Phosphazenylphosphine Ligand
• Authors of publication: Gabino A. Carriedo; Lucía Fernández; Paloma Gómez; Santiago García-Granda; Amador Menéndez Velázquez
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Pages of publication: 20 - 23
• a: 10.563 ± 0.002 Å
• b: 10.603 ± 0.003 Å
• c: 12.25 ± 0.003 Å
• α: 97.68 ± 0.04°
• β: 99.34 ± 0.03°
• γ: 93.11 ± 0.02°
• Cell volume: 1337.6 ± 0.5 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 8
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for significantly intense reflections: 0.0442
• Weighted residual factors for significantly intense reflections: 0.1082
• Duplicate of: 2003168
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No