scholarly journals 1,1,2,2,2,3,3,3-Octacarbonyl-1,1,2,3-tetrakis(1,3,5-triaza-7-phosphatricyclo[3.3.1.13,7]decane-κP)-triangulo-triosmium(0)

IUCrData ◽  
2020 ◽  
Vol 5 (7) ◽  
Author(s):  
David M. Marolf ◽  
Kristen L. Brehm ◽  
Vincent M. Lynch ◽  
Gregory L. Powell
Keyword(s):  
Title Compound ◽  
The Other ◽  
Carbonyl Cluster ◽  
Orthorhombic Space Group ◽  
Space Group ◽  
Carbonyl Ligands ◽  
A Minor

The title compound, [Os3(C6H12N3P)4(CO)8], crystallizes in the orthorhombic space group Pbca with Z = 8. The molecule consists of a triangular triosmium(0) core surrounded by eight carbonyl ligands and four 1,3,5-triaza-7-phosphatricyclo[3.3.1.13,7]decane (or PTA) ligands. One Os atom is coordinated by two PTA ligands and two CO ligands, while the other two Os atoms are each bonded to a single PTA ligand and three CO ligands. There is a small disorder associated with the Os3 unit so that a minor orientation has an occupancy of 2.17 (4)%. The title compound represents the first structurally characterized triangular Os3 carbonyl cluster with four monodentate tertiary phosphane ligands.

Die Kristallstruktur des Lithium-Benzamidinats {Li3[C6H5 - C(NSiMe3)2]3 · NC - C6H5} / The Crystal Structure of the Lithium Phenylamidinate {Li3[C6H5 - C(NSiMe3)2]3 · NC - C6H5}

1994 ◽  
Vol 49 (10) ◽  
pp. 1444-1447 ◽  
Author(s):  
Helmut Goesmann ◽  
Dieter Fenske
Keyword(s):  
Crystal Structure ◽  
Nitrogen Atom ◽  
Single Crystals ◽  
Title Compound ◽  
The Other ◽  
Space Group ◽  
Structure Solution

AbstractSingle crystals of the title compound have been prepared by the reaction of benzonitrile with LiN-(SiMe3)2 in hexane and subsequent evaporation of the solvent. Space group P21/n, Z = 4, structure solution with 7945 observed unique reflections. R = 0.052. Lattice dimensions at -70 °C: a = 1485.2(9); b = 2486.9(11); c = 1568.9(8) pm; β = 91.06(4)°. The compound forms a trimeric ion ensemble in which two of the lithium cations are coordinated by three nitrogen atoms of two phenylamidinate an ions, the other one by four nitrogen atoms of two chelating phenylaminidate anions and in addition by the nitrogen atom of a benzonitrile molecule.

The X-Ray Crystal Structure of 1,2-3,4-Di-O-isopropylidene-4-C-methylthiomethoxy-β-L-arabino-hexoseptanos-5-ulose

1990 ◽  
Vol 43 (12) ◽  
pp. 2083 ◽  
Author(s):  
DC Craig ◽  
VJ James ◽  
JD Stevens
Keyword(s):  
Crystal Structure ◽  
Title Compound ◽  
Membered Ring ◽  
Boat Conformation ◽  
X Ray Diffraction ◽  
Orthorhombic Space Group ◽  
Space Group ◽  
X Ray

The crystal structure of the title compound (1) has been determined by X-ray diffraction. Crystals of (1) are orthorhombic, space group P21212 with a 11.425(1), b 24.916(1), c 5.8952(3)Ǻ, Z 4. Refinement on 1675 observed reflections measured with Cu Kα radiation converged at R 0.034. The seven- membered ring adopts a boat conformation in which the pseudo plane of symmetry passes through the ring oxygen.

Synthese eines kubanartigen Clusterchelats mit einem [Mo3SnS4]6+-Kern / Synthesis of a Cubane-Type Cluster Chelate with a [Mo3SnS4]6+ Core

1990 ◽  
Vol 45 (4) ◽  
pp. 461-464 ◽  
Author(s):  
Helmut Keck ◽  
Andreas Kruse ◽  
Wilhelm Kuchen ◽  
Dietrich Mootz ◽  
René Wiskemann ◽  
...  
Keyword(s):  
Lattice Parameters ◽  
The Other ◽  
Orthorhombic Space Group ◽  
Space Group ◽  
The Core

The cubane-type diamagnetic cluster Mo3SnS4(Et2PS2)6 (1) is obtained by reaction of the “incomplete” cubane Mo3S4(Et2PS2)4 either with tin powder and Et2P(S)—S—S—P(S)Et2 or with bis(diethyldithiophosphinato)tin(II). While the Sn atom and two of the Mo atoms in the core are chelated by Et2PS2⁻, the remaining Mo atom serves as a bridgehead for three dithiophosphinato-ligand bridges to the other metals. 1 crystallizes in the orthorhombic space group Pbca with Z = 8 and lattice parameters a = 2240( 1), b = 2261 ( 1), c = 2401 (1) pm.

Polysulfonylamine, CIII [1] Ein Hydroxylamin mit bemerkenswert kurzer O-N-B Bindung: Kristall- und Molekülstruktur von MeO-N(SO2Me)2 / Polysulfonylamines, C III [1] A Hydroxylamine with a Remarkably Short O-N Bond: Crystal and Molecular Structure of MeO-N(SO2Me)2

1998 ◽  
Vol 53 (5-6) ◽  
pp. 634-636 ◽  
Author(s):  
Martina Näveke ◽  
Armand Blaschette ◽  
Peter G. Jones
Keyword(s):  
Molecular Structure ◽  
Crystal Structure ◽  
Low Temperature ◽  
Title Compound ◽  
Crystal And Molecular Structure ◽  
X Ray Diffraction ◽  
Orthorhombic Space Group ◽  
Space Group ◽  
X Ray ◽  
Bond Angles

Abstract The crystal structure of the known title compound was determined by low-temperature X-ray diffraction (orthorhombic, space group Pbcn, Z = 4). The molecule displays an unusually short O-N bond, a relatively long C-O bond and a moderately pyramidal O-NS2 skeleton (O-N 133.1, C-O 148.5 pm, sum of bond angles at N: 347.4°).

scholarly journals 4-Fluoro-2-({[(2R)-1-hydroxy-1,1,3-triphenylpropan-2-yl]imino}methyl)phenol

IUCrData ◽  
2020 ◽  
Vol 5 (12) ◽  
Author(s):  
Fanrui Sha ◽  
Adam R. Johnson
Keyword(s):  
Hydrogen Bonding ◽  
Solid State ◽  
Title Compound ◽  
Tertiary Alcohol ◽  
Orthorhombic Space Group ◽  
Alcohol Group ◽  
Space Group ◽  
Compound C ◽  
Hydrogen Bonding Network

The title compound, C28H24FNO2, crystallizes in the orthorhombic space group P212121. A hydrogen-bonding network between the tertiary alcohol group and the fluoro substituent results in [010] chains in the solid state.

scholarly journals Polymorphism and pseudosymmetry of 10,10′-oxybis(9-thia-10-hydro-10-boraanthracene)

2019 ◽  
Vol 75 (5) ◽  
pp. 690-694
Author(s):  
Julian Radtke ◽  
Hans-Wolfram Lerner ◽  
Michael Bolte
Keyword(s):  
Title Compound ◽  
The Other ◽  
Asymmetric Unit ◽  
Compound I ◽  
Unit Cell Parameters ◽  
Space Group ◽  
Cell Parameters ◽  
Compound C ◽  
Centrosymmetric Space Group ◽  
Compound Ii

We have encountered two polymorphs of the title compound, C24H16B2OS2, both of which display almost the same unit-cell parameters. Compound (I) crystallizes in the non-centrosymmetric space group P21 with four molecules in the asymmetric unit. These molecules are related by pseudosymmetry. As a result, the space group looks like P21/c, but the structure cannot be refined successfully in that space group. Compound (II) on the other hand crystallizes in the centrosymmetric space group P21/c with only two molecules in the asymmetric unit. The crystals studied for (I) and (II) were both non-merohedral twins.

scholarly journals AP212121polymorph of (+)-clusianone

2013 ◽  
Vol 69 (12) ◽  
pp. o1799-o1800
Author(s):  
Sree Vaneesa Nagalingam ◽  
Janet Wong Pik Ching ◽  
Mohammed Khaled bin Break ◽  
M. Ibrahim M. Tahir ◽  
Teng-Jin Khoo
Keyword(s):  
Hydrogen Bond ◽  
Melting Point ◽  
Structure Determination ◽  
Title Compound ◽  
Specific Rotation ◽  
Slow Evaporation ◽  
Orthorhombic Space Group ◽  
Acta Cryst ◽  
Space Group ◽  
Compound C

The title compound, C33H42O4[systematic name: (1S,5S,7R)-3-benzoyl-4-hydroxy-8,8-dimethyl-1,5,7-tris(3-methylbut-2-enyl)bicyclo[3.3.1]nona-3-ene-2,9-dione], has a central bicyclo[3.3.1]nonane-2,4,9-trione surrounded by tetraprenylated and benzoyl groups. The compound was recrystallized several times in methanol using both a slow evaporation method and with a crystal-seeding technique. This subsequently produced diffraction-quality crystals which crystallize in the orthorhombic space groupP212121, in contrast to a previous report of a structure determination in thePna21space group [McCandlishet al.(1976).Acta Cryst. B32, 1793–1801]. The title compound has a melting point of 365–366 K, and a specific rotation [α]20value of +51.94°. A strong intramolecular O—H...O hydrogen bond is noted. In the crystal, molecules are assembled in theabplane by weak C—H...O interactions.

Crystal structure of 1,6-anhydro-1(6)-thio-β-D-glucopyranose S-oxide

1991 ◽  
Vol 56 (10) ◽  
pp. 2169-2174 ◽  
Author(s):  
Jiří Novotný ◽  
Jaroslav Podlaha ◽  
Miloslav Černý
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonding ◽  
Title Compound ◽  
Direct Methods ◽  
Orthorhombic Space Group ◽  
Space Group

The crystals of the title compound are orthorhombic, space group P212121, a = 6.193(1), b = 6.3734(7), c = 38.553(6)Å, Z = 8. The structure was solved by direct methods and refined to R = 0.035 for 1 460 independent reflections. It is composed of two crystallographically independent but chemically almost identical molecules. The structure is stabilized by hydrogen bonding characterized by strong participation of the sulfoxide groups. A comparison with the structure of the thio derivative demonstrates that the exo-sulfoxide oxygen influences very little the overall conformation of the bicyclic skeleton.

The Effect of Solvent on Isomer Formation. Synthesis and Crystal Structures of CdII Complexes with 3-Nitrobenzoate and Thiourea

2002 ◽  
Vol 55 (9) ◽  
pp. 611 ◽  
Author(s):  
S.-L. Zheng ◽  
W. Li ◽  
G. Yang ◽  
X.-M. Chen ◽  
H.-G. Zhu ◽  
...  
Keyword(s):  
Solvent Effect ◽  
Crystal Structures ◽  
The Other ◽  
Orthorhombic Space Group ◽  
Triclinic Space Group ◽  
Crystal Forms ◽  
Space Group ◽  
Water Solutions ◽  
Effect Of Solvent ◽  
Carboxylate Shift

Two crystal forms of bis(3-nitrobenzoato)bis(thiourea)cadmium(II) were obtained by the reaction of Cd(NO3)2�4H2O, 3-nitrobenzoate (mNA) and thiourea (TU) from ethanol and water solutions, respectively. One is cube-shaped and crystallizes in the orthorhombic space group Pbca and consists of discrete mononuclear molecules of bis(3-nitrobenzoato-O,O�)bis(thiourea)cadmium(II) (1). The other form is needle shaped and crystallizes in the triclinic space group P1–.It is comprised of discrete molecules of bis(3-nitrobenzoato-O,O�)bis(thiourea)cadmium(II) (2) and (3-nitrobenzoato-O,O�)(3-nitrobenzoato-O)bis(thiourea)cadmium(II) (3). (1), (2) and (3) are isomers, in which (1) may be regarded as a structural intermediate between (2) and (3) in the 'carboxylate shift' process. The formation of these isomers may be influenced by the solvent effect.

Cis-2-telluro-1.3.2λ5.4λ3-diazadiphosphetidin - Kristallstruktur eines in Lösung fluktuierenden Redoxsystems / Cis-2-telhirium-1.3.2λ5.4λ3-diazadiphosphetidine - Crystal Structure of a Redox System Fluctuating in Solution

1978 ◽  
Vol 33 (6) ◽  
pp. 610-613 ◽  
Author(s):  
Siegfried Pohl
Keyword(s):  
Crystal Structure ◽  
Single Crystal ◽  
Bond Length ◽  
Title Compound ◽  
Redox System ◽  
Orthorhombic Space Group ◽  
Space Group ◽  
X Ray ◽  
Bond Lengths ◽  
Nitrogen Ring

Abstract The crystal structure of the title compound was determined from single crystal X-ray data. The compound crystallises in the orthorhombic space group Pnma. In contrast to the solution where fluctuating P-Te bonds have been established by NMR analyses the crystals contain isolated molecules with fixed P-Te bonds (bond length: 235.4 pm). The four-membered phosphorus nitrogen ring exhibits significant deviations from planarity. The P-N bond lengths were found to be 168.3 and 175.0 pm, respectively

Sign in / Sign up

Export Citation Format

Share Document