Information card for entry 2000349

Structure parameters

• Formula: C78 H98 Cl12 Gd4 N12 O24
• Calculated formula: C78 H98 Cl12 Gd4 N12 O24
• Title of publication: Structure of a gadolinium hexaaza macrocycle complex with a Gd~2~(OAc)~8~ counterion
• Authors of publication: Smith, P. H.; Ryan, R. R.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1992
• Journal volume: 48
• Journal issue: 12
• Pages of publication: 2127 - 2130
• a: 12.488 ± 0.002 Å
• b: 14.198 ± 0.003 Å
• c: 16.848 ± 0.003 Å
• α: 66.65 ± 0.03°
• β: 69.65 ± 0.03°
• γ: 86.66 ± 0.03°
• Cell volume: 2560.4 ± 1.2 ų
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: Mo
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No