Information card for entry 1549548

Structure parameters

• Formula: C12 H17 Cu1.5 N O12
• Calculated formula: C12 H17 Cu1.5 N O12
• Title of publication: Cu2[Cu(H2O)4][(CH2)4(NH3)2][C6H2(COO)4]2·4H2O — Ein dreidimensionales Koordinationspolymer mit negativer Überschußladung und kanalartigen Hohlräumen
• Authors of publication: Köferstein, Roberto; Robl, Christian
• Journal of publication: Zeitschrift für anorganische und allgemeine Chemie
• Year of publication: 2003
• Journal volume: 629
• Journal issue: 78
• Pages of publication: 1374
• a: 7.9973 ± 0.0007 Å
• b: 9.7743 ± 0.0008 Å
• c: 10.8627 ± 0.0009 Å
• α: 87.194 ± 0.007°
• β: 84.679 ± 0.007°
• γ: 74.744 ± 0.006°
• Cell volume: 815.4 ± 0.12 ų
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.036
• Residual factor for significantly intense reflections: 0.031
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No