Macro-rings designed for uncharged molecule complexation. Synthesis, complex formation, and structural studies of new pyridino crowns incorporating resorcinol and hydroquinone building blocks. X-Ray crystal and molecular structure of a 22-membered pyridino crown

1990 ◽  
pp. 1599-1605 ◽  
Author(s):  
Edwin Weber ◽  
Hans-Jürgen Köhler ◽  
Kaliyamoorthy Panneerselvam ◽  
Kizakkekoikkal K. Chacko
Keyword(s):  
Molecular Structure ◽  
Complex Formation ◽  
Crystal And Molecular Structure ◽  
Building Blocks ◽  
Structural Studies ◽  
X Ray

Structural studies of organoboron compounds. LX. Reaction of sterically hindered arylboronic acids with 2-(hydroxyamino)alkanols. Crystal and molecular structure of 2-mesityl-6,6-pentamethylene-1,3-dioxa-4-aza-2-boracyclohexane

1994 ◽  
Vol 72 (4) ◽  
pp. 1154-1161 ◽  
Author(s):  
Wolfgang Kliegel ◽  
Gottfried Lubkowitz ◽  
Steven J. Rettig ◽  
James Trotter
Keyword(s):  
Molecular Structure ◽  
Least Squares ◽  
Crystal And Molecular Structure ◽  
Direct Methods ◽  
Structural Studies ◽  
Full Matrix ◽  
Space Group ◽  
X Ray ◽  
Arylboronic Acids ◽  
Sterically Hindered

Three 2-(hydroxyamino)alkanols have been reacted with sterically hindered arylboronic acids, ArB(OH)2. When Ar = o-tolyl, 1:2 condensates having bicyclic structures are formed but when Ar = mesityl (2,4,6-(CH3)3C6H2), 1:1 condensates having six-membered cycloboronate structures result. These 1:1 condensates represent the first examples of N-unsubstituted 1,3-dioxa-4-aza-2-boracyclohexane derivatives. An X-ray analysis of one example provides unambiguous proof of the structure. Crystals of 2-mesityl-6,6-pentamethylene-1,3-dioxa-4-aza-2-boracyclohexane, 3c, are monoclinic, a = 11.076(9), b = 23.94(2), c = 13.414(9) Å, β = 109.40(5)°, Z = 8, space group P21/n. The structure was solved by direct methods and refined by full-matrix least-squares procedures to R = 0.051 and Rw = 0.058 for 2037 reflections with I ≥ 3σ(F2).

scholarly journals The Crystal and Molecular Structure of Diazido-2,2′-bipyridinecopper(II)

1974 ◽  
Vol 52 (17) ◽  
pp. 3125-3133 ◽  
Author(s):  
Gordon W. Bushnell ◽  
Masood A. Khan
Keyword(s):  
Molecular Structure ◽  
Crystal And Molecular Structure ◽  
Structural Studies ◽  
X Ray Diffraction ◽  
X Ray ◽  
Bond Lengths ◽  
Square Planar ◽  
Copper Coordination ◽  
Cell Dimensions ◽  
Coordinate Bond

The crystal and molecular structure of diazido-2,2′-bipyridinecopper(II), C10H8N2(N3)2Cu, is determined by single crystal X-ray diffraction, and refined to an R value of 0.067. The cell dimensions are a = 664.9(2), b = 843.3(1), c = 1082.0(2) pm, α = 86.99(2)°, β = 87.77(3)°, γ = 78.59(2)°. The space group is [Formula: see text] (No. 2) with 2 molecules per unit cell and the measured density is 1.71(2) g cm−3. The copper coordination is square planar with two additional longer bonds. The coordinate bond lengths in pm to the bipyridine ligand are: Cu—N(1), 201.6(6); Cu—N(2), 201.9(6). The coordinate bonds to the azido ligands are: Cu—N(3), 194.9(6); Cu—N(6), 196.6(6). The longer bonds are: Cu—N(3)″, 268.0(8), Cu—N(6)′ 268.2(8). The N—N bond lengths within each azido ligand are unequal: N(3)—N(4), 118.2(10); N(4)—N(5), 115.4(11); N(6)—N(7), 119.2(9); N(7)—N(8), 114.8(9). The angles at N(3) and N(6) are both 130° and at N(4) and N(7) the angles are both 175(1)°. Each azide takes part in asymmetric bridging through a single nitrogen atom. The results are compared with other structural studies on azido complexes and to a nitrate complex of Ag(II) which is structurally similar.

Structural studies in the ruthenium(II)/(±)-ortho-Phenylenebis{methyl(phenyl)-phosphine/arsine} system. I. Crystal structure of trans-Carbonylhydridobis-[(±)-ortho-phenylenebis {methyl(phenyl)phosphine)]ruthenium(II)hexafluorophosphate(V)-acetone (1/2)

1983 ◽  
Vol 36 (2) ◽  
pp. 259 ◽  
Author(s):  
SC Grocott ◽  
BW Skelton ◽  
AH White
Keyword(s):  
Molecular Structure ◽  
Crystal Structure ◽  
Diffraction Study ◽  
Crystal And Molecular Structure ◽  
Title Complex ◽  
Structural Studies ◽  
X Ray Diffraction ◽  
X Ray ◽  
Ruthenium Atom ◽  
Methyl Phenyl

The crystal and molecular structure of the title complex, trans-[RuH(CO)(opmpp)2]+ (PF6)-.2(CH3)2- CO [opmpp ≡ (�)-ortho-phenylenebis {methyl(phenyl)phosphine) , o-C6H4(PMePh)2], has been established by a single-crystal X-ray diffraction study at 295(1) K, being refined to a residual of 0.066 for 2293 independent 'observed' reflections. Crystals are monoclinic, C2/c, a 11.943(4), b 26.151(9), c 15.974(6) �, β 90.97(7)�, Z 4. In the model adopted, the ruthenium atom is located on a crystallographic twofold axis; the carbonyl and hydrido ligands lie trans to each other and are disordered about the ruthenium atom. The ruthenium-phosphorus distances are 2.320(2) and 2.317(2)�.

Structural studies in the ruthenium(II)/(±)-ortho-Phenylenebis{methyl(phenyl)-phosphine/arsine} system. III. Crystal structures of Dichlorocarbonyl(dimethyl sulfoxide)-[ortho-phenylenebis {methyl(phenyl)phosphine}]ruthenium(II) and of cis-dicarbonyldichloro[(±)-ortho-phenylenebis{methyl(phenyl)arsine}]ruthenium(II)

1983 ◽  
Vol 36 (2) ◽  
pp. 271 ◽  
Author(s):  
SR Hall ◽  
BW Skelton ◽  
AH White
Keyword(s):  
Molecular Structure ◽  
Diffraction Study ◽  
Dimethyl Sulfoxide ◽  
Crystal And Molecular Structure ◽  
Title Complex ◽  
Structural Studies ◽  
X Ray Diffraction ◽  
X Ray ◽  
Carbonyl Ligands ◽  
Methyl Phenyl

The crystal and molecular structure of the title complex, cis-[Ru(CO)Cl2(dmso)(opmpp)] (1) (dmso ≡ dimethyl sulfoxide, Me2SO; opmpp ≡ (�)-ortho-phenylenebis {methyl(phenyl)phosphine},[o-C6H4(PMePh)2]), has been determined by a single-crystal X-ray diffraction study at 295(1) K, being refined to a residual of 0.050 for 6115 independent 'observed' reflections. Crystals are monoclinic, P21/c, a 11.180(7), b 12.957(6), c 17.567(9) �, β 90.88(5)�, Z 4. The ruthenium-chlorine distances, trans to phosphine and carbonyl ligands, respectively, are 2.469(2), 2.446(2) �; the ruthenium-phosphine distances, trans to the chloride and dimethyl sulfoxide ligands, respectively, are 2.292(1), 2.313(2) �. Ruthenium-sulfur (dmso) is 2.380(2) �, while the ruthenium-carbon(CO) is c. 1.72 �. For cis-[Ru(CO)2Cl2(opmpa)] (2) (opmpa ≡ (�)-ortho-phenylenebis{methyl(phenyl)- arsine}, [o-C6H4(AsMePh)2]), refinement led to a residual of 0.036 for 2423 independent 'observed' reflections. Crystals are monoclinic, P21/c, a 10.497(3), b 11.586(7), c 20.341(9) �, β 105.31(4)�, Z 4. Ruthenium-arsine distances, trans to carbonyl and chlorine ligands, respectively, are 2.404(1), 2.455(1) �. Ruthenium-chlorine distances, trans to arsine and carbonyl ligands, respectively, are 2.443(3), 2.433(2) �, while ruthenium-carbon(CO) distances, trans to arsine and chlorine ligands, respectively, are 1 .920(8), 1 .872(8) �.

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