Information card for entry 8101518

Structure parameters

• Formula: C13 H22 N5 O14 Tl Zr
• Calculated formula: C13 H22 N5 O14 Tl Zr
• Title of publication: Crystal structure of thallium guanidinium zirconium bis(nitrilotriacetate) dihydrate, Tl(C(NH~2~)~3~)Zr(N(CH~2~COO)~3~)~2~ · 2 H~2~O
• Authors of publication: Haussühl, Eiken; Giester, Gerald; Tillmanns, Ekkehart
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 1999
• Journal volume: 214
• Journal issue: 3
• Pages of publication: 375 - 376
• a: 9.941 ± 0.002 Å
• b: 11.209 ± 0.002 Å
• c: 10.639 ± 0.002 Å
• α: 90°
• β: 114.38 ± 0.01°
• γ: 90°
• Cell volume: 1079.8 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for significantly intense reflections: 0.0256
• Weighted residual factors for significantly intense reflections: 0.0623
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No