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Information card for entry 7015746
Preview
Coordinates | 7015746.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C40 H56 N24 Ni4 O24 |
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Calculated formula | C40 H56 N24 Ni4 O24 |
SMILES | c1cccc2C(N)=[N]3N=C4C(C)=[N](O)[Ni]567([O]4[Ni]43([n]12)([OH]C)[N](=C(C1=N[N]2=C(c3cccc[n]3[Ni]32([N](=C(C2=N[N]8=C(c9cccc[n]9[Ni]98([N](=C(C(=N[N]6=C(c6cccc[n]56)N)[O]79)C)O)([O]32)[OH]C)N)C)O)([O]41)[OH]C)N)C)O)[OH]C.N(=O)(=O)[O-].N(=O)(=O)[O-].N(=O)(=O)[O-].N(=O)(=O)[O-] |
Title of publication | Complexes of functionally modified hydrazone ligands‒square, rectangular (M4), trigonal bipyramidal (M5) and pin-wheel (M6) motifs. |
Authors of publication | Anwar, Muhammad U.; Elliott, Andrew S.; Thompson, Laurence K.; Dawe, Louise N. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2011 |
Journal volume | 40 |
Journal issue | 17 |
Pages of publication | 4623 - 4635 |
a | 17.217 ± 0.004 Å |
b | 17.217 ± 0.004 Å |
c | 11.169 ± 0.003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3310.8 ± 1.4 Å3 |
Cell temperature | 153 ± 2 K |
Ambient diffraction temperature | 153 ± 2 K |
Number of distinct elements | 5 |
Space group number | 86 |
Hermann-Mauguin space group symbol | P 42/n :2 |
Hall space group symbol | -P 4bc |
Residual factor for all reflections | 0.1113 |
Residual factor for significantly intense reflections | 0.1088 |
Weighted residual factors for significantly intense reflections | 0.2611 |
Weighted residual factors for all reflections included in the refinement | 0.2633 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.253 |
Diffraction radiation wavelength | 0.71075 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
179861 (current) | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/57. |
7015746.cif |
120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7015746.cif |
35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7015746.cif |
21336 | 2011-06-22 | ../uploads/cif-deposit/cod/cif Adding structures of 7015742, 7015743, 7015744, 7015745, 7015746, 7015747, 7015748, 7015749 via cif-deposit CGI script. |
7015746.cif |
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