Information card for entry 2104496

Structure parameters

• Chemical name: (6,6'-(N, N'-Dibenzyl-N,N'-bis(2-pyridylmethyl)-bis(aminomethyl)-2,2'- bipyridine-iron(ii) bis(hexafluorophosphate).
• Formula: C38 H36 F12 Fe N6 P2
• Calculated formula: C38 H36 F12 Fe N6 P2
• SMILES: c12cccc3[n]1[Fe]145([n]6ccccc6C[N]4(C2)Cc2ccccc2)[n]2c(cccc32)C[N]5(Cc2cccc[n]12)Cc1ccccc1.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Space groups <i>P</i>1 and <i>Cc</i>: how are they doing?
• Authors of publication: Marsh, Richard E.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 6
• Pages of publication: 782 - 783
• a: 17.1997 ± 0.0014 Å
• b: 12.3844 ± 0.0014 Å
• c: 18.0384 ± 0.0013 Å
• α: 90°
• β: 96.486 ± 0.01°
• γ: 90°
• Cell volume: 3817.7 ± 0.6 ų
• Cell temperature: 100 ± 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
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No