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Information card for entry 2012597
Preview
Coordinates | 2012597.cif |
---|---|
Structure factors | 2012597.hkl |
Original IUCr paper | HTML |
Chemical name | {tris[2-(benzylamino)ethyl]amine-κ^4^N}silver(I) perchlorate |
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Formula | C27 H36 Ag Cl N4 O4 |
Calculated formula | C27 H36 Ag Cl N4 O4 |
SMILES | [Ag]123[N](CC[NH]1Cc1ccccc1)(CC[NH]2Cc1ccccc1)CC[NH]3Cc1ccccc1.Cl(=O)(=O)(=O)[O-] |
Title of publication | A pseudo-cage complex of silver(I) with tripodal tetraamine having benzyl end groups, {tris[2-(benzylamino)ethyl]amine-κ^4^<i>N</i>}silver(I) perchlorate |
Authors of publication | Yoon, Il; Shin, Yong Woon; Kim, Jineun; Park, Ki-Min; Park, Sung Bae; Lee, Shim Sung |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 2002 |
Journal volume | 58 |
Journal issue | 3 |
Pages of publication | m165 - m166 |
a | 16.0287 ± 0.0011 Å |
b | 9.6132 ± 0.0007 Å |
c | 20.2697 ± 0.0015 Å |
α | 90° |
β | 110.906 ± 0.001° |
γ | 90° |
Cell volume | 2917.7 ± 0.4 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 6 |
Space group number | 9 |
Hermann-Mauguin space group symbol | C 1 c 1 |
Hall space group symbol | C -2yc |
Residual factor for all reflections | 0.048 |
Residual factor for significantly intense reflections | 0.033 |
Weighted residual factors for significantly intense reflections | 0.081 |
Weighted residual factors for all reflections included in the refinement | 0.09 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.988 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
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