Crystal structures of the novel hydrated borates Ba2B5O9(OH), Sr2B5O9(OH) and Li2Sr8B22O41(OH)2

Three novel hydrated borates Ba2B5O9(OH) (1), Sr2B5O9(OH) (2) and Li2Sr8B22O41(OH)2 (3) have been synthesized hydrothermally and their structures determined. Compounds (1) and (2) are isostructural, crystallizing in space group P21/c and having lattice parameters of a=6.6330(13) Å, b=8.6250(17) Å, c=14.680(3) Å, β=93.46(3)° and a=6.4970(13) Å, b=8.4180(17) Å, c=14.177(3) Å, β=94.35(3)°, respectively. Compound (3) crystallizes in P-1 with lattice parameters of a=6.4684(13) Å, b=8.4513(17) Å, c=14.881(3) Å, α=101.21(3)°, β=93.96(3)°, γ=90.67(3)°. While similar in their axis lengths, (3) differs greatly in structure and formulation from (1) and (2). The structure of (1) and (2) is contrasted to that of the well-known mineral hilgardite (Ca2B5O9Cl·H2O).

Novel hydrated borate structures.Figure optionsDownload as PowerPoint slideHighlights
► Synthesis and crystal structures of three novel hydrated borates are reported.
► Unique descriptive chemistry governing Li2Sr8B22O41(OH)2 synthesis is discussed.
► Structures of Ba2B5O9(OH) and Sr2B5O9(OH) are contrasted to Ca2B5O9Cl·H2O.
► Structure of Li2Sr8B22O41(OH)2 differs from Ba2B5O9(OH) and Sr2B5O9(OH).