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Information card for entry 1513903
Preview
Coordinates | 1513903.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C43 H60 B N3 Ni2 O7 |
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Calculated formula | C43 H60 B N3 Ni2 O7 |
SMILES | [Ni]1234[O]=C(O[Ni]567([O]=C(O1)C)[O]2C(C[N]3(CCC[N]4(C)C)C)C[N]7(CC[O]5C)CC[O]6C)C.c1(ccccc1)[B-](c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | Synthesis and structures of dinickel(II) complexes with a binucleating ligand, N,N'-bis[3-(N,N-dimethyl)aminopropyl]-N,N'-dimethyl-1,3-diamino-2-hydroxypropane (HL1), and investigation of carboxylic acid capture assisted by intramolecular hydrogen bonding |
Authors of publication | Mochizuki, Katsura; Takahashi, Junpei |
Journal of publication | Inorganica Chimica Acta |
Year of publication | 2014 |
Journal volume | 414 |
Pages of publication | 27 - 32 |
a | 12.192 ± 0.007 Å |
b | 12.855 ± 0.007 Å |
c | 15.418 ± 0.009 Å |
α | 87.75 ± 0.03° |
β | 86.166 ± 0.019° |
γ | 67.343 ± 0.009° |
Cell volume | 2225 ± 2 Å3 |
Cell temperature | 298 K |
Ambient diffraction temperature | 298 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for significantly intense reflections | 0.0425 |
Weighted residual factors for all reflections included in the refinement | 0.118 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
Diffraction radiation wavelength | 0.71075 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/1513903.html
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