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Information card for entry 4001097
Preview
Coordinates | 4001097.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H25 Fe N |
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Calculated formula | C30 H25 Fe N |
SMILES | [Fe]12345678([cH]9[cH]1[cH]2[cH]3[cH]49)[cH]1[cH]5[cH]6[cH]7[c]81/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1 |
Title of publication | Electrochemical Deposition of Bis(N,N′-diphenylaminoaryl) Substituted Ferrocenes, and Their Application as a Hole-Injection Layer on Polymeric Light-Emitting Diodes |
Authors of publication | Chiang, Chao Cheng; Chen, Hong-Chun; Lee, Chin-sheng; Leung, Man-kit; Lin, Kun-Rung; Hsieh, Kuo-Huang |
Journal of publication | Chemistry of Materials |
Year of publication | 2008 |
Journal volume | 20 |
Journal issue | 2 |
Pages of publication | 540 |
a | 7.9522 ± 0.0016 Å |
b | 10.827 ± 0.002 Å |
c | 14.369 ± 0.003 Å |
α | 109.02 ± 0.03° |
β | 91.8 ± 0.03° |
γ | 103.57 ± 0.03° |
Cell volume | 1129.1 ± 0.5 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.14 |
Residual factor for significantly intense reflections | 0.0562 |
Weighted residual factors for significantly intense reflections | 0.1081 |
Weighted residual factors for all reflections included in the refinement | 0.1384 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.002 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
178377 (current) | 2016-03-21 | cif/4/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/00. |
4001097.cif |
120073 | 2014-07-11 | Adding DOIs to range 4/00 structures. | 4001097.cif |
41847 | 2012-03-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4001097 via cif-deposit CGI script. |
4001097.cif |
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Users of the data should acknowledge the original authors of the
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