Abstract
C32H48NO2PRh, orthorhombic, P212121 (no. 19), a = 26.784(10) Å, b = 8.837(3) Å, c = 12.759(4) Å, V = 3020.0(18) Å3, Z = 4, Rgt(F) = 0.0400, wRref(F2) = 0.0920, T = 100(2) K.

The molecular structure is shown in the figure. Table 1 contains crystallographic data and Table 2 contains the list of the atoms including atomic coordinates and displacement parameters.
Data collection and handling.
| Crystal: | Yellow block |
| Size: | 0.31 × 0.30 × 0.28 mm |
| Wavelength: | Mo Kα radiation (0.71073 Å) |
| μ: | 0.65 mm−1 |
| Diffractometer, scan mode: | Bruker APEX-II, ω |
| θmax, completeness: | 28.0°, >99% |
| N(hkl)measured, N(hkl)unique, Rint: | 56087, 7280, 0.076 |
| Criterion for Iobs, N(hkl)gt: | Iobs > 2 σ(Iobs), 6798 |
| N(param)refined: | 336 |
| Programs: | SHELX [1], Bruker [2], Diamond [3], Olex2 [4] |
Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2).
| Atom | x | y | z | Uiso*/Ueq |
|---|---|---|---|---|
| Rh1 | 0.40316(2) | 0.82694(4) | 0.61162(3) | 0.03373(10) |
| P1 | 0.37808(4) | 0.67007(16) | 0.48008(9) | 0.0304(2) |
| O1 | 0.47277(13) | 0.7938(4) | 0.5524(3) | 0.0479(10) |
| O2 | 0.29663(17) | 0.8552(8) | 0.6634(5) | 0.097(2) |
| N1 | 0.43465(15) | 0.9765(5) | 0.7250(3) | 0.0349(9) |
| C1 | 0.51311(18) | 0.8757(5) | 0.5652(4) | 0.0340(10) |
| C2 | 0.55303(19) | 0.8580(6) | 0.4928(4) | 0.0412(12) |
| H2 | 0.549356 | 0.787056 | 0.437360 | 0.049* |
| C3 | 0.5965(2) | 0.9386(5) | 0.4995(4) | 0.0435(11) |
| C4 | 0.6369(2) | 0.9251(8) | 0.4184(5) | 0.0572(16) |
| H4A | 0.666947 | 0.881958 | 0.450690 | 0.086* |
| H4B | 0.644657 | 1.025489 | 0.390196 | 0.086* |
| H4C | 0.625586 | 0.858916 | 0.361590 | 0.086* |
| C5 | 0.6024(2) | 1.0380(6) | 0.5850(5) | 0.0480(13) |
| H5 | 0.632771 | 1.092501 | 0.592951 | 0.058* |
| C6 | 0.5650(2) | 1.0569(6) | 0.6564(5) | 0.0439(12) |
| H6 | 0.570075 | 1.123937 | 0.713593 | 0.053* |
| C7 | 0.51905(18) | 0.9796(5) | 0.6478(4) | 0.0352(10) |
| C8 | 0.48107(19) | 1.0178(6) | 0.7224(4) | 0.0380(11) |
| H8 | 0.491369 | 1.082570 | 0.777705 | 0.046* |
| C9 | 0.4053(2) | 1.0490(6) | 0.8078(4) | 0.0432(11) |
| H9 | 0.429241 | 1.105901 | 0.853202 | 0.052* |
| C10 | 0.3753(2) | 0.9435(7) | 0.8796(5) | 0.0548(14) |
| H10A | 0.359296 | 0.861047 | 0.839314 | 0.066* |
| H10B | 0.396714 | 0.899099 | 0.934919 | 0.066* |
| C11 | 0.3368(3) | 1.0500(10) | 0.9257(7) | 0.087(3) |
| H11A | 0.306434 | 0.993237 | 0.945553 | 0.105* |
| H11B | 0.350370 | 1.099817 | 0.989103 | 0.105* |
| C12 | 0.3248(2) | 1.1640(9) | 0.8456(5) | 0.0662(17) |
| H12A | 0.321520 | 1.265107 | 0.878223 | 0.079* |
| H12B | 0.292797 | 1.138495 | 0.810889 | 0.079* |
| C13 | 0.3673(2) | 1.1642(7) | 0.7655(5) | 0.0534(13) |
| H13A | 0.382456 | 1.266033 | 0.759944 | 0.064* |
| H13B | 0.354965 | 1.133358 | 0.695483 | 0.064* |
| C14 | 0.3387(2) | 0.8448(8) | 0.6469(5) | 0.0561(15) |
| C21 | 0.3648(2) | 0.7756(6) | 0.3592(4) | 0.0425(12) |
| H21 | 0.355303 | 0.700647 | 0.303999 | 0.051* |
| C22 | 0.3207(2) | 0.8817(7) | 0.3748(6) | 0.0563(15) |
| H22A | 0.328530 | 0.953599 | 0.431993 | 0.068* |
| H22B | 0.291158 | 0.822069 | 0.396150 | 0.068* |
| C23 | 0.3084(3) | 0.9702(9) | 0.2758(6) | 0.076(2) |
| H23A | 0.281130 | 1.042726 | 0.290492 | 0.091* |
| H23B | 0.296804 | 0.899677 | 0.220581 | 0.091* |
| C24 | 0.3546(4) | 1.0561(10) | 0.2370(7) | 0.094(3) |
| H24A | 0.346675 | 1.107201 | 0.169933 | 0.113* |
| H24B | 0.363738 | 1.134776 | 0.288766 | 0.113* |
| C25 | 0.3976(4) | 0.9513(10) | 0.2214(7) | 0.095(3) |
| H25A | 0.427206 | 1.010646 | 0.199635 | 0.114* |
| H25B | 0.389575 | 0.879592 | 0.164246 | 0.114* |
| C26 | 0.4102(3) | 0.8629(8) | 0.3197(5) | 0.0647(18) |
| H26A | 0.421752 | 0.933413 | 0.374882 | 0.078* |
| H26B | 0.437621 | 0.791129 | 0.304530 | 0.078* |
| C31 | 0.42584(19) | 0.5300(6) | 0.4472(4) | 0.0391(11) |
| H31 | 0.455338 | 0.597257 | 0.435364 | 0.047* |
| C32 | 0.4242(3) | 0.4501(10) | 0.3496(6) | 0.084(3) |
| H32A | 0.424062 | 0.525508 | 0.292222 | 0.101* |
| H32B | 0.392193 | 0.394366 | 0.346077 | 0.101* |
| C33 | 0.4644(3) | 0.3435(10) | 0.3300(7) | 0.083(2) |
| H33A | 0.452762 | 0.270185 | 0.276660 | 0.100* |
| H33B | 0.492703 | 0.400030 | 0.298929 | 0.100* |
| C34 | 0.4830(3) | 0.2592(10) | 0.4187(9) | 0.096(3) |
| H34A | 0.462335 | 0.167136 | 0.426879 | 0.115* |
| H34B | 0.517473 | 0.225871 | 0.402702 | 0.115* |
| C35 | 0.4837(3) | 0.3374(10) | 0.5167(7) | 0.082(2) |
| H35A | 0.515463 | 0.394301 | 0.521407 | 0.098* |
| H35B | 0.483876 | 0.261075 | 0.573423 | 0.098* |
| C36 | 0.4431(2) | 0.4422(7) | 0.5366(5) | 0.0477(13) |
| H36A | 0.453804 | 0.513475 | 0.592100 | 0.057* |
| H36B | 0.414402 | 0.384042 | 0.564540 | 0.057* |
| C18 | 0.2499(3) | 0.3206(10) | 0.5277(7) | 0.082(2) |
| H18A | 0.213609 | 0.314154 | 0.541944 | 0.099* |
| H18B | 0.262517 | 0.215517 | 0.522842 | 0.099* |
| C15 | 0.32237(14) | 0.5514(5) | 0.4993(4) | 0.0391(11) |
| H15 | 0.297576 | 0.634778 | 0.509360 | 0.047* |
| C20 | 0.2991(2) | 0.4803(7) | 0.4108(6) | 0.0610(17) |
| H20A | 0.289996 | 0.560985 | 0.360515 | 0.073* |
| H20B | 0.324634 | 0.416364 | 0.376227 | 0.073* |
| C17 | 0.2727(3) | 0.3890(8) | 0.6156(7) | 0.071(2) |
| H17A | 0.281689 | 0.307582 | 0.665424 | 0.086* |
| H17B | 0.247307 | 0.453005 | 0.650432 | 0.086* |
| C16 | 0.3167(2) | 0.4810(8) | 0.5990(5) | 0.0607(16) |
| H16A | 0.316993 | 0.561435 | 0.653024 | 0.073* |
| H16B | 0.346385 | 0.416648 | 0.611330 | 0.073* |
| C19 | 0.2561(2) | 0.3892(8) | 0.4273(6) | 0.0672(19) |
| H19A | 0.256255 | 0.307682 | 0.374058 | 0.081* |
| H19B | 0.226306 | 0.452679 | 0.413508 | 0.081* |
Source of material
A solution of the [Rh(5-Me-Sal-CyPent)(CO)2], was obtained from the addition of 2-(cyclopentyl)methyl-5-methylphenol (5-Me-Sal-CyPent), to a DMF solution of tetracarbonyl-dichloro-dirhodium(I). The title compound was obtained by the addition of tricyclohexylphosphine (PCy3) to the dicarbonyl precursor. Suitable crystals were obtained upon evaporation of the acetone solution at room temperature.
Experimental details
H-atoms were positioned on geometrically idealized positions and refined using the riding model with fixed C—H distances for aromatic C—H of 0.93 Å (C—H) [Uiso (H) = 1.2 Ueq], for methyl C—H of 0.96 Å (C—H) [Uiso(H) = 1.5 Ueq], for methylene C—H of 0.97 Å (C—H) [Uiso (H) = 1.5 Ueq] and for methine C—H of 0.98 Å (C—H) [Uiso (H) = 1.5 Ueq]. The graphics were obtained using the DIAMOND [3] program with 50% probability ellipsoids. The highest residual peak is located 0.22 Å from H22B and the deepest hole is situated −0.41 Å from H16B.
Comment
The rhodium(I) square planar complexes of the type [Rh(L,L-Bid)(CO)(PR3)], where L,L-Bid = monoanionic bidentate ligands and PR3 represents the tertiary phosphine ligands, have been investigated extensively as potential catalyst precursors [5], [6], [7], [8], [9], [10], [11]. These [Rh(L,L′-Bid)(CO)(PR3)] complexes are in general easily obtained from the substitution of one carbonyl ligand in the parent complex Rh(L,L′-Bid)(CO)2], by monodentate tertiary phosphines. Previous studies have indicated that the substitution of one carbonyl ligand from the parent dicarbonyl complex may lead to the formation of two isomers with preference given to the stronger donor atom when there is a pronounced difference in the nature of the donating and accepting properties between the donor atoms L and L′. If the donor atoms have comparable donor capabilities, the isomers form in comparable ratio [12], [13].
A perspective diagram of the title compound indicates that the phosphine ligand is trans to the nitrogen atom of the Schiff-base ligand in accordance with the relative trans influence of S > N > O atoms [14], [15], [16], [17]. The electronegativity of these donor atoms is not the sole directing factor in the substitution reaction as was indicated in previous studies, that there is competition between the electronic and steric parameters [18], [19], [20].
The central rhodium atom in the title compound is coordinated to a carbonyl ligand, the bulky PCy3 ligand and the nitrogen and oxygen atoms of the bidentate chelate ligand forming a square planar geometry. The square planar orientation around the rhodium atom is distorted from the ideal geometry as indicated by the O1—Rh—N1 bite angle of 89.03(18)° and the C14—Rh—O2 angle of 171.7(2)°. The rhodium central atom is displaced by 0.0351(3) Å from the plane constructed through O1—N1—C14—P1. The Rh—N and Rh—O bond lengths 2.1365(4) Å and 2.0360(6) Å are in good agreement to those found in other rhodium(I) complexes with N,O donor atoms with bond distances spanning around 2.077–2.092 Å and 2.018–2.036 Å for Rh—N and Rh—O respectively [21], [22], [23].
Acknowledgements
We would like to thank the University of the Free State for Financial assistance. We also express our gratitude towards SASOL, Gerdus Kemp and PETLabs Pharmaceuticals, the South African National Research Foundation (SA-NRF) for financial support of this project.
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©2020 Pennie P. Mokolokolo et al., published by De Gruyter, Berlin/Boston
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- Crystal structure of (4-aminobenzoato-κ2O,O′)-[5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane-κ4N,N′,N′′,N′′′]nickel(II) perchlorate monohydrate, C23H44ClN5NiO7
- Crystal structure of 1-{4-[(4-fluoro-2-hydroxy-benzylidene)amino]phenyl}ethanone, C15H12FNO2
- Preparation and crystal structure of a non-symmetrical vanadium(II) dimer: tri-μ2-bromido-(hydrogen-tris(3-isopropyl-4-bromopyrazol-1-yl)borato-κ3N,N′,N′′)-tris(tetrahydrofuran-κO)divanadium(II) – tetrahydrofuran (1/1), C34H57BBr6N6O4V2
- Crystal structure of bis{2-(((4-(1-(hydroxyl-imino)ethyl)phenyl)imino)methyl)phenolato-κ2N,O}cobalt(II), C30H26CoN4O4
- Crystal structure of 3-((3-nitrophenyl)sulfonamido)propanoic acid — 4,4′-bipyridine (1/1), C19H18N4O6S
- Crystal structure of cyclo[diaqua-bis(μ2-3′,5-dicarboxy-[1,1′-biphenyl]-3,4′-dicarboxylato-κ4O,O′:O′′,O′′′)-bis(4,4′-bis(pyrid-4-yl)biphenyl-K1N)dicadmium(II)], C76H52Cd2N4O18
- Crystal structure of 1-(adamantan-1-yl)-3-aminothiourea, C11H19N3S
- Crystal structure of catena-poly[triaqua-(μ2-1,4-di(pyridin-4-yl)benzene-κ2N:N′)-(3′,5-dicarboxy-[1,1′-biphenyl]-3,4′-dicarboxylato-κO)nickel(II)], C32H26N2O11Ni
- Crystal structure of catena-poly[aqua-(μ4-4,4′-(pyridine-3,5-diyl)dibenzoato-κ4O,O′:O′′:O′′′)zinc(II)], C19H13NO5Zn
- Crystal structure of 4-(4′-(pyridin-4-yl)-[1,1′-biphenyl]-4-yl)pyridin-1-ium 2-carboxy-4-(3,5-dicarboxyphenoxy)benzoate hydrate, C38H28N2O10
- Crystal structure of 3-[(triisopropylsilanyl)-ethynyl]-6a,12a-dihydro-1H-1,4-diaza-benzo[α]anthracene-2,7,12-trione, C27H28N2O3Si
- Crystal structure of [(bis(1,10-phenanthroline-κ2N,N′)-(2-carboxy-4-(3-carboxy-5-carboxylatophenoxy)benzoato-κ2O:O′))nickel(II) monohydrate, (1,10-phenanthroline-κ2N:N′)-(μ2-(5-(3′,4′-dicarboxylphenoxy)-isophthalate-κ2O:O′))nickel(II)], C40H24N4O9Ni ⋅ H2O
- Crystal structure of 4-(3-(pyridin-3-yl)ureido)benzoic acid — adipic acid (2/1), C16H16N3O5
- Crystal structure of poly[bis{μ2-5-carboxy-4′-methyl-[1,1′-biphenyl]-3-carboxylato-κ2O:O′}-{μ2-4,4′-bipyridine-κ2N:N′}]cobalt(II), C40H30N2O8Co
- Crystal structure of aqua-(2,2′-bipyridine-κ2N,N′)(((3-nitrophenyl)sulfonyl)glycine-κ2N,O)copper(II) dihydrate, C18H20CuN4O9S
- Crystal structure of bis{2-bromo-6-(((4-(1-(methoxyimino)ethyl)phenyl)imino)methyl)phenolato-κ2N,O}copper(II), C32H28Br2CuN4O4
- Crystal structure of bis(2-(2-((2,6-dichlorophenyl)amino)phenyl)acetato-κ2O,O′)-(1,10-phenanthroline-κ2N,N′)zinc(II), C40H28Cl4N4O4Zn
- Crystal structure of 2-(3,6-dimethyl-2,3-dihydro-4H-benzo[b][1,4]oxazin-4-yl)-2-oxoethyl acetate, C14H17NO4
- Crystal structure of poly[dibromido-bis(μ2-1,6-di(1H-imidazol-1-yl)hexane-κ2N:N′)cadmium(II)], C24H36Br2N8Cd
- Synthesis and crystal structure of ((6R,7S)-3-ethyl-6-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-7-yl)(phenyl)methanone hemihydrate, 2(C19H18N4OS) ⋅ H2O
- Crystal structure of 2-(5-(pyridin-3-yl)-4-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)pyridine, C17H12N6
- The crystal structure of N-((1E,2E)-1,3-bis(4-fluorophenyl)but-2-en-1-ylidene)-4-methylbenzenesulfonamide, C23H19F2NO2S
- Crystal structure of diacetato-κ1O-diethanol-κ1O-bis(μ2-2-(((2-hydroxyethyl)imino)methyl)-5-methoxyphenolato-κ4O,N,O′:O′′)dinickel(II), C28H42Ni2N2O12
- The crystal structure of catena-poly[chlorido-(μ2-1,4-bis(pyridin-3-yl-methoxy)benzene-κ2N:N′)copper(II)], C18H16ClN2O2Cu
- N′,N′′′-(((ethane-1,2-diylbis(oxy))bis(2,1-phenylene))bis(methaneylylidene))bis(2-hydroxybenzohydrazide)nickel(II), C30H24N4NiO6
- Crystal structure of (E)-3′,6′-bis(ethylamino)-2′,7′-dimethyl-2-(2-((quinolin-2-ylmethylene)amino)ethyl)spiro[isoindoline-1,9′-xanthen]-3-one, C38H37N5O2
- Crystal structure of 4,4′-di(1H-imidazol-1-yl)-1,1′-biphenyl-1-ium 5,3′,5′-tricarboxy-[1,10-biphenyl]-2-carboxylate, C25H17N2O8
- The crystal structure of 1-carboxy-2-(1H-indol-3-yl)-N,N,N-trimethylethan-1-ammonium chloride, C14H19N2O2Cl
- The crystal structure of 5-bromo-2-fluoronicotinic acid monohydrate, C6H5BrFNO3
- Crystal structure of ethyl 3-(trifluoromethyl)-1H-pyrazole-4-carboxylate, C7H7F3N2O2
- Crystal structure of tetrakis(1H-benzo[d]imidazol-3-ium) bis(μ5-phenylphosphonato)-pentakis(μ2-oxido)-decaoxo-penta-molybdenum dihydrate, C40H42Mo5N8O23P2
- Structure of 7-(3,3,4,4,5,5-hexafluoro-2-(2-methylbenzo[b]thiophen-3-yl)cyclopent-1-en-1-yl)-8-methylquinoline, C24H15F6NS
- Crystal structure of monocarbonyl[2-((cyclopentylmethylene)amino)-5-methylphenolato-κ2N,O] (tricyclohexylphosphine)rhodium(I), C32H48NO2PRh
- The crystal structure of fac-tricarbonyl(1,10-phenanthroline-κ2N,N′)-(pyrazole-κN)rhenium(I)nitrate, C18H12O3N4Re
- Crystal structure of poly[diaqua-bis(μ2-4-(3-(pyridin-3-yl)-1H-1,2,4-triazol-5-yl)benzoato-κ2N:O)nickel(II)], C28H22O6N8Ni
- Crystal structure of 4,4′-bis(pyridin-1-ium-4-yl)biphenyl poly[bis(μ2-4,4′-bis(pyrid-4-yl)biphenyl-K2N:N′)-tetrakis(μ4-4′-methyl-[1,1′-biphenyl]-3,5-dicarboxylato-K4O,O′:O′′:O′′′)-bis[[μ2-1,1′-biphenyl]-3-carboxyl-5-carboxylato-K2O:O′]tetracobalt(II)]— [1,1′-biphenyl]-3,5-dicarboxylic acid (1/2), C93H68N3O16Co2
- The crystal structure of 4a-formyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydro-1-2-6a,6b,9,9,12a-heptamethylpicen-10-yl acetate, C32H50O3
- Crystal structure of 3,3′-(1,2-phenylenebis(methylene))bis(1-methyl-1H-imidazol-3-ium) bis(hexafluoridophosphate), C16H20F12N4P2
- Crystal structure of catena-poly[diaqua-(μ2-tartrato-κ4O,O′:O′′,O′′′)zinc(II)], C4H8O8Zn
- The crystal structure of (6aR,6bS,8aS,8bR,9S,11aS,12aS,12bS)-10-(4-acetoxy-3-methylbutyl)-6a,8a,9-trimethyl-3,4,5,6,6a,6b,7,8,8a,8b,9,10,11a,12,12a,12b-hexadecahydro-1H-naphtho[2′,1′:4,5]indeno[2,1-b]furan-4-yl acetate, C31H48O5
- Crystal structure of 4,4′-(oxybis(methylene))bis(bromobenzene), C14H12Br2O
- Crystal structure of (N,N-dimethylsulphoxide)-[N-(3-ethoxy-2-(oxide)benzylidene)-3-methoxybenzenecarbohydrazonato-κ3N,O,O′]-dioxo-molybdenum(VI), C19H22MoN2O7S
- Crystal structure of dichlorido-bis(dimethyl sulphoxide-κO)-bis(4-methylbenzyl-κC1)tin(IV), C20H30Cl2O2S2Sn
- Crystal structure of (E)-2-amino-N′-(2-hydroxy-4-(2-(piperidin-1-yl)ethoxy)benzylidene)benzohydrazide monohydrate, C21H26N4O3 ⋅ H2O
- Crystal structure of chloridotris(4-chlorophenyl)(dimethyl sulfoxide-κO)tin(IV), C20H18Cl4OSSn
- Crystal structure of catena{di-aqua-sodium-[N-(hydroxyethyl), N-isopropyl-dithiocarbamato]}n, [C6H16NNaO2S2]n
- Crystal structure of 2,2,4,4,6,6-hexakis(4-chlorophenyl)-1,3,5,2,4,6-trithiatristanninane, C36H24Cl6S3Sn3
- Crystal structure of 6-methoxy-3-(5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl)-4H-chromen-4-one-methanol (1/1), C20H18N2O6
- Crystal structure of hexanedihydrazide, C6H14N4O2
- Crystal structure of tert-butyl 2-(hydroxymethyl)-5-{4-[(methoxycarbonyl)amino]phenyl}-2,5-dihydro-1H-pyrrole-1-carboxylate, C18H24N2O5
- Crystal structure of [(Z)-O-isopropyl N-(4-nitrophenyl)thiocarbamato-κS]-(triphenylphosphine-κP)-gold(I), C28H26AuN2O3PS
- Crystal structure of [O-ethyl N-(4-nitrophenyl)thiocarbamato-κS](tri-4-tolylphosphine-κP)gold(I) tetrahydrofuran solvate, C30H30AuN2O3PS, C4H8O
Articles in the same Issue
- Frontmatter
- Crystal structure of isopimara-7,15-dien-3-one, C20H30O
- Crystal structure of bis(6-aminopyridine-2-carboxylato-κ2O,N)-copper(II), C12H10O6N4Cu
- Crystal structure of 5,6-diphenyldibenzo[c, g]chrysene, C38H24
- Poly[bis(dimethylformamide-κO)-(μ8-5,5′′-dicarboxy-[1,1′:4′,1′′-terphenyl]-2′,3,3′′,5′-tetracarboxylato-κ8O:O1:O2:O3:O4:O5:O6:O7)dizinc(II)] — dimethylformamide (1/2), C18H19N2O8Zn
- The crystal structure of poly[bis(N,N-dimethylformamide-κ1O)(μ4- 2′,5,5′,5′′-tetracarboxy-[1,1′:4′,1′′-terphenyl]-3,3′′-dicarboxylato-κ4O:O′:O′′:O′′′)manganese(II)] — N,N-dimethylformamide (1/2), C36H40N4O16Mn
- Crystal structure of N,N-dimethyl-4-((7-nitrobenzo[c][1,2,5]thiadiazol-4-yl)ethynyl)aniline, C16H12N4O2S
- The crystal structure of 8a-methoxy 8a-methoxy-1,5,8a,9a-tetrahydro-4H-8,9-dioxa-3a1λ4-aza-8aλ4, C18H14BNO3
- Crystal structure of poly[diaqua-(μ2-5-isopropoxyisophthalato-κ2O:O′)-(μ2-(1,3-bis(3,5-di(1H-imidazol-1-yl)pyridine))-κ2N:N′)cobalt(II)] monohydrate, C22H25N5O8Co
- The crystal structure of acetoximium 1′-hydroxy-1H,1H′-5,5′-bitetrazole-1-olate monohydrate, C5H11N9O4
- Crystal structure of 3-(2-ethoxy-2-oxoethyl)-1-vinyl-1H-imidazol-3-ium hexafluoridophosphate(V), C9H13F6N2O2P
- The crystal structure of catena-poly[(μ2-4-(benzo[d]imidazol-2-yl)benzenecarboxylato-κ2N,O)-(μ2-4-(benzo[d]imidazol-2-yl)benzenecarboxylato-κ3N,O:O′)cadmium(II)]dihydrate, C28H22CdN4O6
- Enzyme-mediated synthesis and crystal structure of (2R,4S)-hydroxyketamine, C13H16ClNO2
- The crystal structure of bis(isothiocyanato-κ1N)-(methanol-κ1O)-[2-morpholine-4-yl-4,6-di(pyrazol-1-yl)-1,3,5-triazine-κ3N,N′,N′′] manganese(II), C16H18MnN10O2S2
- Crystal structure of bis{5-chloro-2-(((4-trifluoromethyl)imino)methyl)phenolato-κ2N,O}copper(II), C28H16Cl2CuF6N2O2
- Crystal structure of bis(1,3-phenylenedimethanaminium) bis(triiodide) tetraiodide – water (1/2) , C8H16I5N2O
- Crystal structure and anti-inflammatory activity of (3E,5E)-3,5-bis(2-fluorobenzylidene)-1-((4-fluorophenyl)sulfonyl)piperidin-4-one, C25H18F3NO3S
- The crystal structure of bis{3-(diphenylphosphaneyl)propanoato-κ2O,P}platinum(II) dihydrate, C30H28O6P2Pt
- The crystal structure of (E)-2-(4-((4-fluorobenzyl)oxy)styryl)-4,6-dimethoxybenzaldehyde, C24H21FO4
- Crystal structure of bis[3-methoxy-N-(1-(pyrazin-2-yl)ethylidene)benzohydrazonato-κ3O,N,N′]nickel(II), C28H26N8O4Ni
- Crystal structure of 1-(2-(pyridin-2-yl)-5-(pyridin-3-yl)-1,3,4-oxadiazol-3(2H)-yl)ethan-1-one, C14H12N4O2
- Synthesis and crystal structure of 3-N-acetyl-5-(pyridin-3-yl)-2-(quinolin-2-yl)-1,3,4-oxadiazoline, C18H14N4O2
- Crystal structure of 2-methyl-1H-perimidine, C12H10N2
- Crystal structure of (E)-2-(5,5-dimethyl-3-(4-((7-nitrobenzo[c][1,2,5]oxadiazol-4-yl)oxy)styryl)cyclohex-2-en-1-ylidene)malononitrile, C25H19N5O4
- Structural elucidation of 1-(3-acetyl-2,6-dihydroxy-4-methoxyphenyl)-4,5-dihydroxy-2-methylanthracene-9,10-dione isolated from Bulbine latifolia (L.) Wild, C24H18O8
- Crystal structure of 3-cinnamoyl-4-hydroxybenzoic acid, C16H12O4
- The crystal structure of poly[bis(μ4-2,3-pyridinedicarboxylato)-(μ2-oxalyl dihydrazide)-dicadmium(II) dihydrate], C16H16O12N6Cd2
- Synthesis and crystal structure of 1-{4-[(3-bromo-2-hydroxy-benzylidene)amino]phenyl}ethanone, C15H12BrNO2
- Synthesis and crystal structure of 1-{4-[(2-bromo-6-hydroxy-benzylidene)amino]phenyl}ethanone, C15H12BrNO2
- Crystal structure of (4-aminobenzoato-κ2O,O′)-[5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane-κ4N,N′,N′′,N′′′]nickel(II) perchlorate monohydrate, C23H44ClN5NiO7
- Crystal structure of 1-{4-[(4-fluoro-2-hydroxy-benzylidene)amino]phenyl}ethanone, C15H12FNO2
- Preparation and crystal structure of a non-symmetrical vanadium(II) dimer: tri-μ2-bromido-(hydrogen-tris(3-isopropyl-4-bromopyrazol-1-yl)borato-κ3N,N′,N′′)-tris(tetrahydrofuran-κO)divanadium(II) – tetrahydrofuran (1/1), C34H57BBr6N6O4V2
- Crystal structure of bis{2-(((4-(1-(hydroxyl-imino)ethyl)phenyl)imino)methyl)phenolato-κ2N,O}cobalt(II), C30H26CoN4O4
- Crystal structure of 3-((3-nitrophenyl)sulfonamido)propanoic acid — 4,4′-bipyridine (1/1), C19H18N4O6S
- Crystal structure of cyclo[diaqua-bis(μ2-3′,5-dicarboxy-[1,1′-biphenyl]-3,4′-dicarboxylato-κ4O,O′:O′′,O′′′)-bis(4,4′-bis(pyrid-4-yl)biphenyl-K1N)dicadmium(II)], C76H52Cd2N4O18
- Crystal structure of 1-(adamantan-1-yl)-3-aminothiourea, C11H19N3S
- Crystal structure of catena-poly[triaqua-(μ2-1,4-di(pyridin-4-yl)benzene-κ2N:N′)-(3′,5-dicarboxy-[1,1′-biphenyl]-3,4′-dicarboxylato-κO)nickel(II)], C32H26N2O11Ni
- Crystal structure of catena-poly[aqua-(μ4-4,4′-(pyridine-3,5-diyl)dibenzoato-κ4O,O′:O′′:O′′′)zinc(II)], C19H13NO5Zn
- Crystal structure of 4-(4′-(pyridin-4-yl)-[1,1′-biphenyl]-4-yl)pyridin-1-ium 2-carboxy-4-(3,5-dicarboxyphenoxy)benzoate hydrate, C38H28N2O10
- Crystal structure of 3-[(triisopropylsilanyl)-ethynyl]-6a,12a-dihydro-1H-1,4-diaza-benzo[α]anthracene-2,7,12-trione, C27H28N2O3Si
- Crystal structure of [(bis(1,10-phenanthroline-κ2N,N′)-(2-carboxy-4-(3-carboxy-5-carboxylatophenoxy)benzoato-κ2O:O′))nickel(II) monohydrate, (1,10-phenanthroline-κ2N:N′)-(μ2-(5-(3′,4′-dicarboxylphenoxy)-isophthalate-κ2O:O′))nickel(II)], C40H24N4O9Ni ⋅ H2O
- Crystal structure of 4-(3-(pyridin-3-yl)ureido)benzoic acid — adipic acid (2/1), C16H16N3O5
- Crystal structure of poly[bis{μ2-5-carboxy-4′-methyl-[1,1′-biphenyl]-3-carboxylato-κ2O:O′}-{μ2-4,4′-bipyridine-κ2N:N′}]cobalt(II), C40H30N2O8Co
- Crystal structure of aqua-(2,2′-bipyridine-κ2N,N′)(((3-nitrophenyl)sulfonyl)glycine-κ2N,O)copper(II) dihydrate, C18H20CuN4O9S
- Crystal structure of bis{2-bromo-6-(((4-(1-(methoxyimino)ethyl)phenyl)imino)methyl)phenolato-κ2N,O}copper(II), C32H28Br2CuN4O4
- Crystal structure of bis(2-(2-((2,6-dichlorophenyl)amino)phenyl)acetato-κ2O,O′)-(1,10-phenanthroline-κ2N,N′)zinc(II), C40H28Cl4N4O4Zn
- Crystal structure of 2-(3,6-dimethyl-2,3-dihydro-4H-benzo[b][1,4]oxazin-4-yl)-2-oxoethyl acetate, C14H17NO4
- Crystal structure of poly[dibromido-bis(μ2-1,6-di(1H-imidazol-1-yl)hexane-κ2N:N′)cadmium(II)], C24H36Br2N8Cd
- Synthesis and crystal structure of ((6R,7S)-3-ethyl-6-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-7-yl)(phenyl)methanone hemihydrate, 2(C19H18N4OS) ⋅ H2O
- Crystal structure of 2-(5-(pyridin-3-yl)-4-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)pyridine, C17H12N6
- The crystal structure of N-((1E,2E)-1,3-bis(4-fluorophenyl)but-2-en-1-ylidene)-4-methylbenzenesulfonamide, C23H19F2NO2S
- Crystal structure of diacetato-κ1O-diethanol-κ1O-bis(μ2-2-(((2-hydroxyethyl)imino)methyl)-5-methoxyphenolato-κ4O,N,O′:O′′)dinickel(II), C28H42Ni2N2O12
- The crystal structure of catena-poly[chlorido-(μ2-1,4-bis(pyridin-3-yl-methoxy)benzene-κ2N:N′)copper(II)], C18H16ClN2O2Cu
- N′,N′′′-(((ethane-1,2-diylbis(oxy))bis(2,1-phenylene))bis(methaneylylidene))bis(2-hydroxybenzohydrazide)nickel(II), C30H24N4NiO6
- Crystal structure of (E)-3′,6′-bis(ethylamino)-2′,7′-dimethyl-2-(2-((quinolin-2-ylmethylene)amino)ethyl)spiro[isoindoline-1,9′-xanthen]-3-one, C38H37N5O2
- Crystal structure of 4,4′-di(1H-imidazol-1-yl)-1,1′-biphenyl-1-ium 5,3′,5′-tricarboxy-[1,10-biphenyl]-2-carboxylate, C25H17N2O8
- The crystal structure of 1-carboxy-2-(1H-indol-3-yl)-N,N,N-trimethylethan-1-ammonium chloride, C14H19N2O2Cl
- The crystal structure of 5-bromo-2-fluoronicotinic acid monohydrate, C6H5BrFNO3
- Crystal structure of ethyl 3-(trifluoromethyl)-1H-pyrazole-4-carboxylate, C7H7F3N2O2
- Crystal structure of tetrakis(1H-benzo[d]imidazol-3-ium) bis(μ5-phenylphosphonato)-pentakis(μ2-oxido)-decaoxo-penta-molybdenum dihydrate, C40H42Mo5N8O23P2
- Structure of 7-(3,3,4,4,5,5-hexafluoro-2-(2-methylbenzo[b]thiophen-3-yl)cyclopent-1-en-1-yl)-8-methylquinoline, C24H15F6NS
- Crystal structure of monocarbonyl[2-((cyclopentylmethylene)amino)-5-methylphenolato-κ2N,O] (tricyclohexylphosphine)rhodium(I), C32H48NO2PRh
- The crystal structure of fac-tricarbonyl(1,10-phenanthroline-κ2N,N′)-(pyrazole-κN)rhenium(I)nitrate, C18H12O3N4Re
- Crystal structure of poly[diaqua-bis(μ2-4-(3-(pyridin-3-yl)-1H-1,2,4-triazol-5-yl)benzoato-κ2N:O)nickel(II)], C28H22O6N8Ni
- Crystal structure of 4,4′-bis(pyridin-1-ium-4-yl)biphenyl poly[bis(μ2-4,4′-bis(pyrid-4-yl)biphenyl-K2N:N′)-tetrakis(μ4-4′-methyl-[1,1′-biphenyl]-3,5-dicarboxylato-K4O,O′:O′′:O′′′)-bis[[μ2-1,1′-biphenyl]-3-carboxyl-5-carboxylato-K2O:O′]tetracobalt(II)]— [1,1′-biphenyl]-3,5-dicarboxylic acid (1/2), C93H68N3O16Co2
- The crystal structure of 4a-formyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydro-1-2-6a,6b,9,9,12a-heptamethylpicen-10-yl acetate, C32H50O3
- Crystal structure of 3,3′-(1,2-phenylenebis(methylene))bis(1-methyl-1H-imidazol-3-ium) bis(hexafluoridophosphate), C16H20F12N4P2
- Crystal structure of catena-poly[diaqua-(μ2-tartrato-κ4O,O′:O′′,O′′′)zinc(II)], C4H8O8Zn
- The crystal structure of (6aR,6bS,8aS,8bR,9S,11aS,12aS,12bS)-10-(4-acetoxy-3-methylbutyl)-6a,8a,9-trimethyl-3,4,5,6,6a,6b,7,8,8a,8b,9,10,11a,12,12a,12b-hexadecahydro-1H-naphtho[2′,1′:4,5]indeno[2,1-b]furan-4-yl acetate, C31H48O5
- Crystal structure of 4,4′-(oxybis(methylene))bis(bromobenzene), C14H12Br2O
- Crystal structure of (N,N-dimethylsulphoxide)-[N-(3-ethoxy-2-(oxide)benzylidene)-3-methoxybenzenecarbohydrazonato-κ3N,O,O′]-dioxo-molybdenum(VI), C19H22MoN2O7S
- Crystal structure of dichlorido-bis(dimethyl sulphoxide-κO)-bis(4-methylbenzyl-κC1)tin(IV), C20H30Cl2O2S2Sn
- Crystal structure of (E)-2-amino-N′-(2-hydroxy-4-(2-(piperidin-1-yl)ethoxy)benzylidene)benzohydrazide monohydrate, C21H26N4O3 ⋅ H2O
- Crystal structure of chloridotris(4-chlorophenyl)(dimethyl sulfoxide-κO)tin(IV), C20H18Cl4OSSn
- Crystal structure of catena{di-aqua-sodium-[N-(hydroxyethyl), N-isopropyl-dithiocarbamato]}n, [C6H16NNaO2S2]n
- Crystal structure of 2,2,4,4,6,6-hexakis(4-chlorophenyl)-1,3,5,2,4,6-trithiatristanninane, C36H24Cl6S3Sn3
- Crystal structure of 6-methoxy-3-(5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl)-4H-chromen-4-one-methanol (1/1), C20H18N2O6
- Crystal structure of hexanedihydrazide, C6H14N4O2
- Crystal structure of tert-butyl 2-(hydroxymethyl)-5-{4-[(methoxycarbonyl)amino]phenyl}-2,5-dihydro-1H-pyrrole-1-carboxylate, C18H24N2O5
- Crystal structure of [(Z)-O-isopropyl N-(4-nitrophenyl)thiocarbamato-κS]-(triphenylphosphine-κP)-gold(I), C28H26AuN2O3PS
- Crystal structure of [O-ethyl N-(4-nitrophenyl)thiocarbamato-κS](tri-4-tolylphosphine-κP)gold(I) tetrahydrofuran solvate, C30H30AuN2O3PS, C4H8O