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Information card for entry 7115743
Preview
Coordinates | 7115743.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C42 H40 N6 |
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Calculated formula | C42 H40 N6 |
SMILES | n1c2ccc1=C(c1[nH]c(C(=c3nc(C(=c4[nH]c(=C2c2ccncc2)cc4)CCCCC)cc3)C#Cc2ccncc2)cc1)CCCCC |
Title of publication | Molecular tectonics based nanopatterning of interfaces with 2D metal-organic frameworks (MOFs) |
Authors of publication | Mohamed El Garah; Artur Ciesielski; Nicolas Marets; Veronique Bulach; Mir Wais Hosseini; Paolo Samori |
Journal of publication | Chem.Commun. |
Year of publication | 2014 |
Journal volume | 50 |
Pages of publication | 12250 |
a | 9.8125 ± 0.0003 Å |
b | 14.2149 ± 0.0005 Å |
c | 14.358 ± 0.0006 Å |
α | 81.339 ± 0.002° |
β | 71.164 ± 0.002° |
γ | 86.24 ± 0.002° |
Cell volume | 1873.53 ± 0.12 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 3 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1394 |
Residual factor for significantly intense reflections | 0.0661 |
Weighted residual factors for significantly intense reflections | 0.1792 |
Weighted residual factors for all reflections included in the refinement | 0.2005 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.028 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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