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Information card for entry 7014041
Preview
Coordinates | 7014041.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | Bis(N,N-dimethylaminoethyl-1,2,3,4-tetramethylcyclopentadienyl)barium(II) |
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Formula | C26 H44 Ba N2 |
Calculated formula | C26 H44 Ba N2 |
SMILES | [Ba]123456789%10([N](CC[c]%111[c]2([c]3([c]4([c]5%11C)C)C)C)(C)C)[N](CC[c]16[c]7([c]8([c]9([c]1%10C)C)C)C)(C)C |
Title of publication | Synthesis and characterisation of cyclopentadienyl complexes of barium: precursors for atomic layer deposition of BaTiO3. |
Authors of publication | Hatanpää, Timo; Vehkamäki, Marko; Mutikainen, Ilpo; Kansikas, Jarno; Ritala, Mikko; Leskelä, Markku |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2004 |
Journal issue | 8 |
Pages of publication | 1181 - 1188 |
a | 17.028 ± 0.005 Å |
b | 17.028 ± 0.005 Å |
c | 47.342 ± 0.005 Å |
α | 90 ± 0.005° |
β | 90 ± 0.005° |
γ | 120 ± 0.005° |
Cell volume | 11888 ± 5 Å3 |
Cell temperature | 193 ± 2 K |
Ambient diffraction temperature | 193 ± 2 K |
Number of distinct elements | 4 |
Space group number | 167 |
Hermann-Mauguin space group symbol | R -3 c :H |
Hall space group symbol | -R 3 2"c |
Residual factor for all reflections | 0.0588 |
Residual factor for significantly intense reflections | 0.0492 |
Weighted residual factors for significantly intense reflections | 0.1139 |
Weighted residual factors for all reflections included in the refinement | 0.1193 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.081 |
Diffraction radiation wavelength | 0.71069 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7014041.html
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