Information card for entry 1005051

Structure parameters

• Chemical name: Barium copper nitride (16/13/15)
• Formula: Ba16 Cu13 N15
• Calculated formula: Ba16 Cu13 N15
• Title of publication: Breaking up chains: the nitridocuprates(I) Ba (Cu N), Ba16 ((Cu N)8)(Cu2 N3) (Cu3 N4) and Ca4 Ba (Cu N2)2
• Authors of publication: Niewa, R; DiSalvo, F J
• Journal of publication: Journal of Alloys Compd.
• Year of publication: 1998
• Journal volume: 279
• Pages of publication: 153 - 160
• a: 9.5611 ± 0.0004 Å
• b: 7.2731 ± 0.0002 Å
• c: 13.5225 ± 0.0005 Å
• α: 90°
• β: 93.115 ± 0.002°
• γ: 90°
• Cell volume: 938.9 ų
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.072
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No