{[Pb(μ2-H2TFMIDC)2-(μ2-H2O)]·H2O}n, H3TFMIDC= 2-(trifluoromethyl)-4,5-imidazole dicarboxylic acid (H2Pb[C6N2O4HF3]2[H2O]2) Crystal Structure
General Information
- Phase Label(s): H2Pb[C6N2O4HF3]2[H2O]2
- Structure Class(es): –
- Classification by Properties: –
- Mineral Name(s): –
- Pearson Symbol: mP132
- Space Group: 14
- Phase Prototype: H2Pb[C6N2O4HF3]2[H2O]2
- Measurement Detail(s): automatic diffractometer; 5153 (determination of cell parameters), automatic diffractometer; Bruker AXS APEX II (determination of structural parameters), X-rays, Mo Kα; λ = 0.071073 nm (determination of cell and structural parameters), T = 293(2) K (determination of cell and structural parameters)
- Phase Class(es): –
- Compound Class(es): trifluoromethyl-imidazole-dicarboxylate, hydrate
- Interpretation Detail(s): positions of non-H and part of H atoms determined, full-matrix least-squares refinement on F2; 304 variables; 2928 reflections; I > 2σ(I), R = 0.0968; wR = 0.2542
- Sample Detail(s): sample prepared from Pb[NO3]2, 2-(trifluoromethyl)-4,5-imidazole dicarboxylic acid, single crystal (determination of cell parameters), single crystal, 0.25×0.28×0.30 mm3 (determination of structural parameters)
Substance Summary
- Standard Formula: H2Pb[C6N2O4HF3]2[H2O]2
- Alphabetic Formula: [C6N2O4HF3]2[H2O]2H2Pb
- Published Formula: {[Pb(μ2-H2TFMIDC)2-(μ2-H2O)]·H2O}n, H3TFMIDC= 2-(trifluoromethyl)-4,5-imidazole dicarboxylic acid
- Refined Formula: C12F6H8N4O10Pb
- Wyckoff Sequence: 14,e33
- Z Formula Units: 4
- Density: ρ = 2.29 Mg·m−3
Crystallographic Data
Cell Parameters
Atom Coordinates
Standardized
Published
Displacement Parameters
Isotropic
Anisotropic
Experimental Details
Reference
3D Interactive Structure
About this content
PAULING FILE Multinaries Edition – 2012
sd_1722355
©Springer & Material Phases Data System (MPDS), Switzerland & National Institute for Materials Science (NIMS), Japan, 2016
Pierre Villars, Material Phases Data System (MPDS), CH-6354 Vitznau, Switzerland
SpringerMaterials Release 2016.
Data generated pre-2002: © Springer & MPDS & NIMS; post-2001: © Springer & MPDS
All Rights Reserved. Version 2016.10.
Project Coordinator: Shuichi Iwata
Section-Editor: Karin Cenzual (Crystal Structures)
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