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Information card for entry 1573613
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Coordinates | 1573613.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | (η^6^-Benzene)chlorido[2-(pyridin-2-yl)quinoline-κ^2^<i>N</i>,<i>N</i>']\ ruthenium(II) tetrafluoridoborate |
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Formula | C20 H16 B Cl F4 N2 Ru |
Calculated formula | C20 H16 B Cl F4 N2 Ru |
SMILES | [Ru]123456(Cl)([cH]7[cH]3[cH]4[cH]5[cH]6[cH]27)[n]2c3c(ccc2c2[n]1cccc2)cccc3.[B](F)(F)(F)[F-] |
Title of publication | (η6-Benzene)chlorido[2-(pyridin-2-yl)quinoline-κ2 N,N′]ruthenium(II) tetrafluoridoborate |
Authors of publication | Varadhan, Manikandan; Passi, Ibanpynhunlang; Chinnathangavel, Thangaraja; Rajendiran, Venugopal |
Journal of publication | IUCrData |
Year of publication | 2025 |
Journal volume | 10 |
Journal issue | 1 |
a | 8.4191 ± 0.0003 Å |
b | 23.1476 ± 0.0009 Å |
c | 9.9079 ± 0.0003 Å |
α | 90° |
β | 94.709 ± 0.003° |
γ | 90° |
Cell volume | 1924.35 ± 0.12 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 7 |
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 | 0.0464 |
Residual factor for significantly intense reflections | 0.0396 |
Weighted residual factors for significantly intense reflections | 0.0896 |
Weighted residual factors for all reflections included in the refinement | 0.0931 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.129 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
297208 (current) | 2025-01-08 | cif/ Adding structures of 1573613 via cif-deposit CGI script. |
1573613.cif |
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Users of the data should acknowledge the original authors of the
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