Search results for "Nuclear magnetic resonance spectroscopy"

showing 10 items of 843 documents

Über polystannane

1985

Abstract The compound I(t-Bu2Sn)4I has been synthesized by controlled cleavage of the related cyclotetrastannane (t-Bu2Sn)4 with iodine in toluene. Both compounds have been investigated by mass, NMR and vibrational spectra. I(t-Bu2Sn)4I: δ(119Snterminal) 67.7, δ(Sncentral) 17.4 ppm; 1J(SnSn) 2199 (terminal-central) and 1575 (central-central), 2J(SnSn) 20 (terminal-central), 3J (SnSn) 307 Hz (terminal-terminal); ν(SnSn) 119, ν(SnI) 167 cm−1. (t-Bu2Sn)4: δ(Sn) 87.4 ppm; ν(SnSn) 125 cm−1. The crystal structure of I(t-Bu2Sn)4I has been determined (R = 0.071): bond lengths SnSn 289.5(1) (terminal-central) and 292.4(1) (central-central), SnI 275.3(1) pm. The conformation of the chain ISn…

StereochemistryOrganic ChemistryCrystal structureNuclear magnetic resonance spectroscopyBiochemistryTolueneInorganic ChemistryBond lengthCrystallographychemistry.chemical_compoundchemistryX-ray crystallographyMaterials ChemistryMass spectrumMoleculePhysical and Theoretical ChemistryPolystannaneJournal of Organometallic Chemistry
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Über polygermane

1985

Abstract [(Cl 3 CCOO)Ph 2 Ge] 2 reacts with wet acetone to give Ph 8 Ge 4 O 2 , and with dry H 2 S to give Ph 8 Ge 4 S 2 . With Na 2 S or NaHSe, Ph 4 Ge 2 Cl 2 yields Ph 8 Ge 4 S 2 and Ph 8 Ge 4 Se 2 , respectively. Only Ph 6 Ge 3 S 2 or Ph 6 Ge 3 Se 2 , but no Ph 6 Ge 3 O 2 , can be obtained from a mixture of Ph 4 Ge 2 Cl 2 , Ph 2 GeCl 2 and Na 2 S or NaHSe. The mass spectra show a high stability of the cations Ph 6 Ge 3 S 2 + and Ph 6 Ge 3 Se 2 + . The 13 C NMR phenyl signals for C( ipso ) shift to high field in the series O, S, Se and 6-membered, 5-membered rings. The crystal structures of Ph 8 Ge 4 O 2 ( R = 0.031) and Ph 6 Ge 3 S 2 ( R = 0.036) have been determined. The 6-membered ring…

StereochemistryOrganic ChemistryCyclohexane conformationCrystal structureNuclear magnetic resonance spectroscopyCarbon-13 NMRBiochemistryInorganic Chemistrychemistry.chemical_compoundCrystallographychemistryX-ray crystallographyMaterials ChemistryAcetoneMass spectrumMoleculePhysical and Theoretical ChemistryJournal of Organometallic Chemistry
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Über bismut-haltige heterocyclen

1985

Abstract Methyl and phenyl oxadithia and trithiabismocanes have been synthesized from methyl or phenyl diethoxybismutane and the respective dithiol. The light-sensitive compounds have been investigated by mass, vibrational and 13C NMR spectra: ν(BiMe) 470–460, ν(BiS2) 300–240 cm−1; δ(13Me) −12 ppm. The crystal structure of 5-phenyl-1,4,6,5-oxadithiabismocane has been determined (R = 0.056). The eight-membered ring has the chair-chair conformation. Besides three direct bonds (BiPh 225(2), BiS 256.0(2) and 260.2(3) pm) there are one transannular (Bi⋯O 297(1) and two intermolecular contacts (Bi ⋯S 344.0(3) and 350.9(3) pm) to bismuth in resulting a ψ-monocapped octahedral sphere of coordina…

StereochemistryOrganic ChemistryDithiolCrystal structureNuclear magnetic resonance spectroscopyRing (chemistry)BiochemistryInorganic Chemistrychemistry.chemical_compoundCrystallographychemistryOctahedronX-ray crystallographyMaterials ChemistryMass spectrumMoleculePhysical and Theoretical ChemistryJournal of Organometallic Chemistry
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Bimetallic Complexes from Amphoteric Group 13/15 Ligands: Syntheses and X-ray Crystal Structures

2002

Bimetallic, pentel-bridged complexes of the type [(dmap)Me 2 -M-E(SiMe 3 ) 2 -M'(CO) n ] (M = Al, Ga; E=P, As, Sb; M'=Cr, Fe, Ni; DMAP= 4-(dimethylamino)pyridine) are formed by reactions of DMAP-coordinated monomeric Group 13/15 compounds [(dmap)Me 2 M-E(SiMe 3 ) 2 ] with the transition metal complexes [(Me 3 N)Cr-(CO) 5 ], [Fe 3 (CO) 1 2 ], and [Ni(CO) 4 ]. For the first time, this reaction offers a general pathway to compounds containing a Group 13 metal and a transition metal bridged by a pentel atom. Complexes prepared in this way were characterized by IR and multinuclear NMR spectroscopy and by single-crystal X-ray structure analysis. Their electronic and structural properties are disc…

StereochemistryOrganic ChemistryGeneral ChemistryCrystal structureNuclear magnetic resonance spectroscopyCatalysisMetalCrystallographychemistry.chemical_compoundMonomerMain group elementchemistryTransition metalvisual_artPyridinevisual_art.visual_art_mediumBimetallic stripChemistry - A European Journal
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Herbizide, VI [1] kernfluorierte 2,4-dianilino-6-(dihexylamino)-1,3,5-triazine

1985

Zusammenfassung Auf dem Wege der nucleophilen Substitution der Chloratome in 2,4-Dichlor- 6-(dihexylamino)-1,3,5-triazin durch Anilin werden das 2,4-Dianilino-6-(dihexylamino)-1,3,5-triazin und durch fluorierte Amine die (Dihexylamino)- 1,3,5-triazine mit den folgenden Resten zuganglich: (2-Fluoranilino)-, (3-Fluoranilino)-, (4-Fluoranilino)-, (2,4-Difluoranilino)-, (2,5-Difluoranilino)- und (2,6-Difluoranilino)-. Zur Charakterisierung der neuen Verbindungen sind die IR-, 1 H-NMR- und Massenspektroskopie herangezogen worden. 2,4-Bis-(2,4-difluoranilino)-6-(dihexylamino)-1,3,5-triazin vermag insbesondere herbizide und antidiabetische Wirkungen auszuuben.

StereochemistryOrganic ChemistryNuclear magnetic resonance spectroscopyBiochemistryMedicinal chemistryInorganic Chemistrychemistry.chemical_compoundAnilinechemistry135-TriazineNucleophilic substitutionMass spectrumEnvironmental ChemistryPhysical and Theoretical ChemistryJournal of Fluorine Chemistry
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NMR studies on [Rh(η6-arene)(P(OPH)3)2]ClO4 in the presence of acetone-d6. Arene dissociation and dynamic behaviour of the solvent complex

1985

Abstract Dissociation of the complexes [Rh(η 6 -arene)L 2 ]ClO 4 (arene = mesitylene (Ia), toluene (Ib) and benzene (Ic); L = P(OPh) 3 ) with loss of the arene ligand in CD 2 Cl 2 / acetone- d 6 (95/5 mol/mol) has been studied by 31 P NMR spectroscopy; for initial 0.025 M concentrations of degrees of dissociation were 0.23, 0.33 and 0.85, respectively. The dissociations were first-order, with half-lifes of 31 (Ia), 1.2 (Ib) and 0.7 (Ic) h. The solvent complex [Rh(acetone) m L 2 ]ClO 4 produced by these dissociation reactions showed unusual dynamic structural behaviour. In dry acetone the two phosphorus nuclei were magnetically equivalent (species II-A 2 ), whereas in acetone solutions conta…

StereochemistryOrganic ChemistryNuclear magnetic resonance spectroscopyBiochemistryTolueneMedicinal chemistryInorganic ChemistrySolventchemistry.chemical_compoundchemistryMaterials ChemistryAcetoneMoleculePhysical and Theoretical ChemistrySolvent effectsBenzeneMesityleneJournal of Organometallic Chemistry
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Über polygermane

1986

Abstract The germylene Ph2Ge of Ph2GeHCl and Net3 inserts in excess Ph2GeHCl and forms polygermanes Cl(Ph2Ge)nH. This one-pot reaction and subsequent chlorination to Cl(Ph2Ge)nCl has been optimized. Increasing amounts of NEt3 step up the yields of higher polygermanes. The 13C NMR phenyl signals for C(ipso) shift to low field with increasing chain length. The crystal structures of Cl(Ph2Ge)3,4Cl (R = 0.072 and 0.087) have been determined. The position of Cl(Ph2Ge)4Cl is split off by disorder (main molecule 82%, side molecule 18%). Two crystallographically different molecules of the trigermane are present; the ClGe3Cl chain contains anti-gauche and gauche-gauche conformation respectively (d…

StereochemistryOrganic ChemistryNuclear magnetic resonance spectroscopyCrystal structureCarbon-13 NMRBiochemistryInorganic ChemistryCrystallographychemistry.chemical_compoundChain lengthchemistryOne pot reactionX-ray crystallographyMaterials ChemistryMoleculePhysical and Theoretical ChemistryTriethylamineJournal of Organometallic Chemistry
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13C NMR of carbonyl compounds. 3. Structure and dynamics of protonated enones and dienones

1984

Abstract The unsaturated ketones 1 1 – 10 10 were protonated at low temperatures and studied by dynamic 13C NMR spectroscopy. Four interconverting stereoisomers were detected which differ in their conformation with respect to the CO and CC (enone) single bond.

StereochemistryOrganic ChemistryProtonationNuclear magnetic resonance spectroscopyCarbon-13 NMRBiochemistrychemistry.chemical_compound13c nmr spectroscopychemistryComputational chemistryNMR spectroscopy of stereoisomersDrug DiscoverySingle bondEnoneTetrahedron Letters
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Dinuclear Ortho-Metalated Palladium(II) Compounds with N,N- and N,O-Donor Bridging Ligands. Synthesis of New Palladium(III) Complexes

2011

New dinuclear ortho-metalated palladium(II) compounds with N,N′-diarylformamidinates, Pd2[(C6H4)PPh2]2[R′NC(H)NR′]2 (R′ = C6H5, 3a; R′ = p-CH3C6H4, 3b; R′ = p-CH3OC6H4, 3c) and N,O-donor ligands, Pd2[(C6H4)PPh2]2[N,O]2 (N,O = succinimidate (5), phtalimidate (6), 2-hydroxypyridinate (7), acetanilidate (8)) have been synthesized and characterized by NMR spectroscopy and X-ray diffraction methods. The oxidation with iodobenzene dichloride gave new and rare Pd26+ compounds, Pd2[(C6H4)PPh2]2[R′NC(H)NR′]2Cl2 (R′ = C6H5, 4a; R′ = p-CH3C6H4, 4b). DFT calculations on the Pd24+ → Pd26+ oxidation reaction show that the substituents on the amidinate N atoms have a greater effect on the reaction energy …

StereochemistryOrganic ChemistryReaction energychemistry.chemical_elementNuclear magnetic resonance spectroscopyMedicinal chemistryRedoxCatalysisInorganic Chemistrychemistry.chemical_compoundchemistryIodobenzene dichlorideAtomPhysical and Theoretical ChemistryPalladiumOrganometallics
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Complexes hétéronucléaires Cp2MM′(Cp)(CO)3 (M  Nb, Ta; M′  Mo, W) avec groupes carbonyles pontants et semi-pontants: synthèse et comportement dynam…

1991

Abstract Heteronuclear structures Cp 2 MM′(Cp)(CO) 3 (M  Nb, Ta; M′  Mo, W) are obtained by heating Cp 2 MH 3 (M  Nb, Ta) with Cp 2 M′ 2 (CO) 6 (M′  Mo, W) or starting from Cp 2 M(CO)H and Cp 2 M′ 2 (CO) 4 . These heterobimetallic complexes show three CO coordination modes: terminal, semi-bridging and bridging. The two cyclopentadienyl groups of the Cp 2 M moiety are anisochronous owing to molecular rigidity; rotation barriers around the MM′ bond have been estimated and are greatest with tantalum derivatives.

StereochemistryOrganic ChemistryTantalumchemistry.chemical_elementNuclear magnetic resonance spectroscopyIon pairsBiochemistryInorganic ChemistryCrystallographychemistry.chemical_compoundchemistryCyclopentadienyl complexHeteronuclear moleculeMaterials ChemistryMoietyPhysical and Theoretical ChemistryMetalloceneJournal of Organometallic Chemistry
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