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Information card for entry 8102652
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Coordinates | 8102652.cif |
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Chemical name | 1,1'-Bis(((1<i>R</i>,2<i>S</i>,5<i>R</i>)-2-isopropyl-5-methylcyclohexyl) cyclopentadienyl)-1-trimethylphosphine-2,3-bis(trimethylsilyl)-1- hafnacycloprop-2-ene hexane solvate (1:0.5), C~41~H~73~HfPSi~2~ 0.5 C~6~H~14~ |
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Formula | C44 H80 Hf P Si2 |
Calculated formula | C44 H80 Hf P Si2 |
Title of publication | Crystal structure of 1-bis(((1R,2S,5R)-2-isopropyl-5-methylcyclohexyl)cyclopentadienyl)-1-trimethylphosphine-2,3-bis(trimethylsilyl)-1-hafnacycloprop-2-ene — hexane (1:0.5), (HfC8H18Si2)(C15H22)2(PC3H9) · 0.5C6H14 |
Authors of publication | Marcus Klahn; Anke Spannenberg; Uwe Rosenthal |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2010 |
Journal volume | 225 |
Journal issue | 2 |
Pages of publication | 262 |
a | 14.96343 ± 0.00017 Å |
b | 14.96343 ± 0.00017 Å |
c | 44.927 ± 0.0008 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 10059.3 ± 0.2 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 5 |
Space group number | 92 |
Hermann-Mauguin space group symbol | P 41 21 2 |
Hall space group symbol | P 4abw 2nw |
Residual factor for all reflections | 0.0321 |
Residual factor for significantly intense reflections | 0.0262 |
Weighted residual factors for significantly intense reflections | 0.0724 |
Weighted residual factors for all reflections included in the refinement | 0.0733 |
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 | Yes |
Has Fobs | No |
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