Microporous, noncentrosymmetric, octahedral/tetrahedral-framework phases: K2/3Li1/3Nb2PO8, K2/3Li1/3Ta2PO8 and K2/3Ag1/3Nb2PO8
Abstract
The syntheses, crystal structures and some properties of K2/3Li1/3Nb2PO8, K2/3Li1/3Ta2PO8 and K2/3Ag1/3Nb2PO8 are reported. They consist of an octahedral (MO6: M = Nb, Ta)/tetrahedral (PO4) framework, built up from M–O–P and M–O–M bonds, surrounding cavities and channels occupied by the Ag+/Li+ and K+ cations. The degree of distortion of the NbO6 and TaO6 octahedra are similar for all these phases. The extraframework cations occupy different, distinct sites, depending primarily on their ionic radii, with a concomitant effect on physical properties of the crystals. The degree of “underbonding” of these guest species is similar to that found for the same cations in aluminosilicate zeolite materials.
Crystal data: K2/3Li1/3Nb2PO8, Mr = 373.22, rhombohedral, space group R32 (No. 155), a = 8.3918(2) Å, α = 104.148(1)°, V = 525.79(3) Å3, Z = 3, Rp = 4.88%, Rwp = 7.61% and χ2 = 1.19 for 117 parameters and 21505 observations (time-of-flight powder neutron diffraction data; 0.6 < d < 4.0 Å). K2/3Li1/3Ta2PO8, Mr = 549.24, rhombohedral, R32 (No. 155), a = 8.3791(2) Å, α = 104.141(1)°, V = 523.46(3) Å3, Z = 3, Rp = 4.06%, Rwp = 6.23%, χ2 = 1.15, 113 parameters, 21505 observations, 0.6 < d < 4.0 Å. K2/3Ag1/3Nb2PO8, Mr = 406.80, rhombohedral, R32 (No. 155), a = 8.5215(2) Å, α = 104.698(1)°, V = 544.42(8) Å3, Z = 3, Rp = 5.47%, Rwp = 6.95%, χ2 = 1.75 (constant-wavelength powder neutron diffraction data), 51 parameters, 3395 observations.
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Artikel in diesem Heft
- Microporous, noncentrosymmetric, octahedral/tetrahedral-framework phases: K2/3Li1/3Nb2PO8, K2/3Li1/3Ta2PO8 and K2/3Ag1/3Nb2PO8
- Proton disorder of water molecules in the structure of lithium hydrogen cis-4-cyclohexene-1,2-dicarboxylate dihydrate, LiHC8H8O4 · 2 H2O
- Crystal structures of tetrabutylbis[(2-(benzoylthio)acetato)]-distannoxane and tetrabutylbis[2-(2,4-dichloro-5-methylphenylthio)-acetato]distannoxane dimers
- Crystal structure of racemic trans-2-(4-methylphenyl)-cyclohexanol
- Crystal structure of 2-bromomethyl-1-(2′-methoxy-3,5-dimethyl)-naphthalene1
- Structures of the hydrogen (+)-tartrates of sodium, thallium(I) and silver(I)
- Crystal structures of N-aryl-N-pentopyranosylamines
- Crystal structure of 2-triphenylstannyl 1,2-benzisothiazol-3(2H)-one 1,1-dioxide-quinoline N-oxide (1/1) molecular complex
- The Crystal Structure of benzoyl – histidine monohydrate
- Crystal and molecular structure of tris (1,3-diphenylpropane-1,3-dionato)cobalt(III)
- Crystal and molecular structure of 3,5-dimethyl-N-nitroso-4-oximino-2,6-diphenyl piperidin-4-one(DMNOH)1
- Crystal structure of dicaesium tetrachlorothulate(II), Cs2TmCl4
- Crystal structure of bis(triphenylphosphine)iminium bis(l,3-dithiole-2-thione-4,5-dithiolato)aurate(III) dichloromethane hemisolvate, [N(P(C6H5)3)2]+[(C3S5)2Au]−· ½ CH2C12
- Crystal structure of 2-(1-carboxyphenyl)-N-methylammonium chloride hydrate, [o-HOOC(C6H4)NH2(CH3)]+Cl−·H2O
- Crystal structure of 2-(1-carboxyphenyl)-N-methylammonium chloride, [o-HOOC(C6H4)NH2(CH3)]+ Cl−
- Redetermination of the crystal structure of N-methylanthranilic acid, o-H3CNHC6H4CO2H
- Crystal structure of dimethylammonium bromide, (CH3)2NH2+Br−
- Crystal structure of (Z)-3-(4-benzyloxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)propenoic acid, C24H22O6
- Crystal structure of 1,3-diisopropyl-4,5-dimethylimidazolium chloride tris(trichlormethane), C11H21CIN2 · 3CHCl3
- Crystal structure of μ2-(dicyclohexylphosphino)-μ2-[(bis(trimethylsilyl)methylene)phosphino]hexacarbonyl-diiron(Fe-Fe), ((H3C)3Si)2CP(C6H11)2PFe2(CO)6
- Crystal structure of tetracarbonyl(η2,1η4,1 -3-tert-butyl-1,1,5,5-tetrakis(trimethylsilyl)-2,3,4-triphosphapenta-1,4-diene) molybdenum(0), ((H9C4)((H3C)3Si)4(C2P3))Mo(CO)4
- Crystal structure of carbonyl(η1.2,2η4.5,2 -3-tert-butyl-1,1,5,5-tetrakis(trimethylsilyl)-2,3,4-triphosphapenta-1,4-diene)-nickel(0), ((H3C)3Si)4(C4H9)C2P3NiCO
- Crystal structure of μ2-(di-tert-butylphosphino)-μ2-[(dicarbonyl-η2-(bis(trimethylsilyl)methylene)phosphino)-nickel(0)]-tetracarbonyldinickel(Ni-Ni), (C4H9)2P[((CH3)3Si)2CPNi(CO)2](CO)4Ni2
- Crystal structure of dicarbonyl(cyclopentadienyl)-[2-tert-butyl-3-phenyl-3-trimethylsilyl]diphosphiranido(1−)iron, (H5C6)((H3C)3Si)C(H9C4)P2Fe(CO)2(C5H5)
- Crystal structure of (5R,2R)-5-chloro-1-methoxycarbonyl-piperidine-2-carboxylic acid amide, C8H13ClN2O3
- Crystal structure of cesium-tert-butanolate, CsOC4H9
Artikel in diesem Heft
- Microporous, noncentrosymmetric, octahedral/tetrahedral-framework phases: K2/3Li1/3Nb2PO8, K2/3Li1/3Ta2PO8 and K2/3Ag1/3Nb2PO8
- Proton disorder of water molecules in the structure of lithium hydrogen cis-4-cyclohexene-1,2-dicarboxylate dihydrate, LiHC8H8O4 · 2 H2O
- Crystal structures of tetrabutylbis[(2-(benzoylthio)acetato)]-distannoxane and tetrabutylbis[2-(2,4-dichloro-5-methylphenylthio)-acetato]distannoxane dimers
- Crystal structure of racemic trans-2-(4-methylphenyl)-cyclohexanol
- Crystal structure of 2-bromomethyl-1-(2′-methoxy-3,5-dimethyl)-naphthalene1
- Structures of the hydrogen (+)-tartrates of sodium, thallium(I) and silver(I)
- Crystal structures of N-aryl-N-pentopyranosylamines
- Crystal structure of 2-triphenylstannyl 1,2-benzisothiazol-3(2H)-one 1,1-dioxide-quinoline N-oxide (1/1) molecular complex
- The Crystal Structure of benzoyl – histidine monohydrate
- Crystal and molecular structure of tris (1,3-diphenylpropane-1,3-dionato)cobalt(III)
- Crystal and molecular structure of 3,5-dimethyl-N-nitroso-4-oximino-2,6-diphenyl piperidin-4-one(DMNOH)1
- Crystal structure of dicaesium tetrachlorothulate(II), Cs2TmCl4
- Crystal structure of bis(triphenylphosphine)iminium bis(l,3-dithiole-2-thione-4,5-dithiolato)aurate(III) dichloromethane hemisolvate, [N(P(C6H5)3)2]+[(C3S5)2Au]−· ½ CH2C12
- Crystal structure of 2-(1-carboxyphenyl)-N-methylammonium chloride hydrate, [o-HOOC(C6H4)NH2(CH3)]+Cl−·H2O
- Crystal structure of 2-(1-carboxyphenyl)-N-methylammonium chloride, [o-HOOC(C6H4)NH2(CH3)]+ Cl−
- Redetermination of the crystal structure of N-methylanthranilic acid, o-H3CNHC6H4CO2H
- Crystal structure of dimethylammonium bromide, (CH3)2NH2+Br−
- Crystal structure of (Z)-3-(4-benzyloxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)propenoic acid, C24H22O6
- Crystal structure of 1,3-diisopropyl-4,5-dimethylimidazolium chloride tris(trichlormethane), C11H21CIN2 · 3CHCl3
- Crystal structure of μ2-(dicyclohexylphosphino)-μ2-[(bis(trimethylsilyl)methylene)phosphino]hexacarbonyl-diiron(Fe-Fe), ((H3C)3Si)2CP(C6H11)2PFe2(CO)6
- Crystal structure of tetracarbonyl(η2,1η4,1 -3-tert-butyl-1,1,5,5-tetrakis(trimethylsilyl)-2,3,4-triphosphapenta-1,4-diene) molybdenum(0), ((H9C4)((H3C)3Si)4(C2P3))Mo(CO)4
- Crystal structure of carbonyl(η1.2,2η4.5,2 -3-tert-butyl-1,1,5,5-tetrakis(trimethylsilyl)-2,3,4-triphosphapenta-1,4-diene)-nickel(0), ((H3C)3Si)4(C4H9)C2P3NiCO
- Crystal structure of μ2-(di-tert-butylphosphino)-μ2-[(dicarbonyl-η2-(bis(trimethylsilyl)methylene)phosphino)-nickel(0)]-tetracarbonyldinickel(Ni-Ni), (C4H9)2P[((CH3)3Si)2CPNi(CO)2](CO)4Ni2
- Crystal structure of dicarbonyl(cyclopentadienyl)-[2-tert-butyl-3-phenyl-3-trimethylsilyl]diphosphiranido(1−)iron, (H5C6)((H3C)3Si)C(H9C4)P2Fe(CO)2(C5H5)
- Crystal structure of (5R,2R)-5-chloro-1-methoxycarbonyl-piperidine-2-carboxylic acid amide, C8H13ClN2O3
- Crystal structure of cesium-tert-butanolate, CsOC4H9