Abstract
C36H30IOPSn, monoclinic, P21 (no. 4), a = 9.7251(6) Å, b = 17.3609(11) Å, c = 10.0542(6) Å, β = 114.379(1)°, V = 1546.16(17) Å3, Z = 2, Rgt(F) = 0.0113, wRref(F2) = 0.0301, T = 296(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 prism |
| Size: | 0.25 × 0.15 × 0.11 mm |
| Wavelength: | Mo Kα radiation (0.71073 Å) |
| μ: | 1.90 mm−1 |
| Diffractometer, scan mode: | Bruker SMART APEX, ω |
| θmax, completeness: | 28.3°, >99% |
| N(hkl)measured, N(hkl)unique, Rint: | 19627, 7642, 0.015 |
| Criterion for Iobs, N(hkl)gt: | Iobs > 2 σ(Iobs), 7603 |
| N(param)refined: | 361 |
| Programs: | Bruker [1], SHELX [2], [3], WinGX/ORTEP [4] |
Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2).
| Atom | x | y | z | Uiso*/Ueq |
|---|---|---|---|---|
| I1 | −0.18870(2) | 0.38832(2) | 0.05116(2) | 0.01789(4) |
| Sn | 0.06869(2) | 0.46646(2) | 0.26278(2) | 0.01190(3) |
| P1 | 0.41973(6) | 0.52683(3) | 0.57287(5) | 0.01174(9) |
| O1 | 0.28159(17) | 0.53146(8) | 0.43105(15) | 0.0159(3) |
| C1 | −0.0002(2) | 0.57881(11) | 0.1729(2) | 0.0134(4) |
| C2 | 0.1057(2) | 0.63274(12) | 0.1717(2) | 0.0172(4) |
| H2 | 0.207877 | 0.620464 | 0.213908 | 0.021* |
| C3 | 0.0596(3) | 0.70497(12) | 0.1077(2) | 0.0189(4) |
| H3 | 0.130991 | 0.739977 | 0.105447 | 0.023* |
| C4 | −0.0915(3) | 0.72471(12) | 0.0477(2) | 0.0184(4) |
| H4 | −0.121905 | 0.772898 | 0.005251 | 0.022* |
| C5 | −0.1982(2) | 0.67209(13) | 0.0510(2) | 0.0188(4) |
| H5 | −0.299745 | 0.685555 | 0.013131 | 0.023* |
| C6 | −0.1525(2) | 0.59922(12) | 0.1113(2) | 0.0157(4) |
| H6 | −0.224476 | 0.563736 | 0.110407 | 0.019* |
| C7 | 0.2293(2) | 0.40758(11) | 0.2079(2) | 0.0137(4) |
| C8 | 0.2589(3) | 0.43316(12) | 0.0904(2) | 0.0201(4) |
| H8 | 0.205208 | 0.474620 | 0.034470 | 0.024* |
| C9 | 0.3677(3) | 0.39717(14) | 0.0569(3) | 0.0263(5) |
| H9 | 0.386785 | 0.414805 | −0.021231 | 0.032* |
| C10 | 0.4484(3) | 0.33520(13) | 0.1386(3) | 0.0239(5) |
| H10 | 0.522026 | 0.311647 | 0.116083 | 0.029* |
| C11 | 0.4189(2) | 0.30838(13) | 0.2541(2) | 0.0207(4) |
| H11 | 0.472112 | 0.266432 | 0.308709 | 0.025* |
| C12 | 0.3097(2) | 0.34435(12) | 0.2881(2) | 0.0169(4) |
| H12 | 0.289962 | 0.325986 | 0.365368 | 0.020* |
| C13 | 0.0288(2) | 0.43000(12) | 0.4461(2) | 0.0145(4) |
| C14 | 0.0249(2) | 0.48489(12) | 0.5459(2) | 0.0171(4) |
| H14 | 0.035243 | 0.536809 | 0.529250 | 0.021* |
| C15 | 0.0055(2) | 0.46269(15) | 0.6704(2) | 0.0210(4) |
| H15 | 0.001474 | 0.499811 | 0.735392 | 0.025* |
| C16 | −0.0077(2) | 0.38541(15) | 0.6973(2) | 0.0223(4) |
| H16 | −0.018538 | 0.370565 | 0.781366 | 0.027* |
| C17 | −0.0049(3) | 0.32990(13) | 0.5983(2) | 0.0216(4) |
| H17 | −0.014614 | 0.278016 | 0.615726 | 0.026* |
| C18 | 0.0126(3) | 0.35237(12) | 0.4730(2) | 0.0191(4) |
| H18 | 0.013509 | 0.315252 | 0.406657 | 0.023* |
| C19 | 0.3874(2) | 0.57723(11) | 0.7135(2) | 0.0139(4) |
| C20 | 0.4537(2) | 0.55538(12) | 0.8599(2) | 0.0172(4) |
| H20 | 0.518933 | 0.513437 | 0.888888 | 0.021* |
| C21 | 0.4219(3) | 0.59649(14) | 0.9625(2) | 0.0232(5) |
| H21 | 0.463779 | 0.581182 | 1.059846 | 0.028* |
| C22 | 0.3271(3) | 0.66081(14) | 0.9197(3) | 0.0258(5) |
| H22 | 0.307009 | 0.688628 | 0.988693 | 0.031* |
| C23 | 0.2636(3) | 0.68299(13) | 0.7753(3) | 0.0250(5) |
| H23 | 0.200758 | 0.725860 | 0.747214 | 0.030* |
| C24 | 0.2928(3) | 0.64181(12) | 0.6717(3) | 0.0196(4) |
| H24 | 0.249452 | 0.657063 | 0.574326 | 0.024* |
| C25 | 0.5760(2) | 0.57320(11) | 0.5535(2) | 0.0148(4) |
| C26 | 0.6857(3) | 0.61284(13) | 0.6683(3) | 0.0226(5) |
| H26 | 0.681089 | 0.614469 | 0.758768 | 0.027* |
| C27 | 0.8024(3) | 0.65006(14) | 0.6487(3) | 0.0278(5) |
| H27 | 0.875730 | 0.676635 | 0.725757 | 0.033* |
| C28 | 0.8090(3) | 0.64737(13) | 0.5136(3) | 0.0265(5) |
| H28 | 0.886108 | 0.672876 | 0.499563 | 0.032* |
| C29 | 0.7012(3) | 0.60682(15) | 0.3994(3) | 0.0268(5) |
| H29 | 0.707261 | 0.604502 | 0.309591 | 0.032* |
| C30 | 0.5847(3) | 0.56979(13) | 0.4182(2) | 0.0210(4) |
| H30 | 0.512351 | 0.542733 | 0.341236 | 0.025* |
| C31 | 0.4753(2) | 0.42993(11) | 0.6328(2) | 0.0146(4) |
| C32 | 0.5937(2) | 0.39505(13) | 0.6113(2) | 0.0172(4) |
| H32 | 0.653135 | 0.423939 | 0.577333 | 0.021* |
| C33 | 0.6229(3) | 0.31698(13) | 0.6407(2) | 0.0196(4) |
| H33 | 0.700655 | 0.293458 | 0.624792 | 0.023* |
| C34 | 0.5357(3) | 0.27412(13) | 0.6940(2) | 0.0209(4) |
| H34 | 0.555849 | 0.221999 | 0.713991 | 0.025* |
| C35 | 0.4189(2) | 0.30857(13) | 0.7176(2) | 0.0198(4) |
| H35 | 0.361168 | 0.279690 | 0.753584 | 0.024* |
| C36 | 0.3885(2) | 0.38644(13) | 0.6871(2) | 0.0163(4) |
| H36 | 0.310302 | 0.409697 | 0.702874 | 0.020* |
Source of material
All chemicals and solvents were used as purchased without purification. The melting point was determined on a Mel-temp II digital melting point apparatus and was uncorrected. The IR spectrum was obtained on a Bruker Vertex 70v FTIR Spectrometer from 4000 to 400 cm−1.
Triphenyltin iodide was prepared from the reaction of triphenyltin chloride (Merck) with sodium iodide (Sigma-Aldrich) [5]. Triphenyltin iodide (0.48 g, 1 mmol) and triphenylphosphine oxide (Sigma-Aldrich; 0.27 g, 1 mmol) in chloroform (30 mL) were refluxed for 2 h. After filtration, the filtrate was evaporated slowly until yellow crystals were formed. The crystals were filtered, washed with a minimum amount of hexane and air-dried. Yield: 0.21 g (28%). M.pt: 370–372 K. IR (cm−1) 1590 (m) ν(C—C), 1116 (m) ν(P—O), 1070 (m) ν(C—O), 446 (w) ν(Sn—O).
Experimental details
The C-bound H atoms were geometrically placed (C—H = 0.95 Å) and refined as riding with Uiso(H) = 1.2Ueq(C). Owing to poor agreement, one reflection, i.e. (3 3 1), was omitted from the final cycles of refinement. The absolute structure was determined based on differences in the Friedel pairs included in the data set.
Comment
The crystal and molecular structures of the title compound, Ph3SnI⋅O=PPh3, (I), were determined as part of an on-going investigation of oxide adducts of organotin species, such as phosphineoxide [6], arsineoxide [7] and sulphoxide [8], [9]. A search of the crystallographic literature [10] reveals there are no reports of simple R3SnI⋅O=PR’3 adducts.
The molecular structure of (I) is shown in the figure (70% displacement ellipsoids). The tin atom exists within a C3IO donor set defined by the three ipso-carbon atoms of the phenyl substituents [range of Sn—C bond lengths: Sn—C7 = 2.122(2) Å to Sn—C1 2.138(2) Å], an iodide [Sn—I1 = 2.8699(2) Å] and the phosphineoxide-O1 atom [2.3517(15) Å]. The resultant penta-coordinated geometry is based on a trigonal bipyramid with electronegative substituents occupying axial positions; the I1—Sn—O1 axial angle is 178.43(4)°. The tin-bound organo substituents occupy equatorial positions with the range of C—Sn—C angles being 117.73(8)° for C1—Sn—C7, to 119.98(8)° for C1—Sn—C13. The Sn atom lies 0.1910(12) Å out of the C3 equatorial plane in the direction of the I1 atom. The P1—O1 bond length is 1.5044(15) Å and the Sn—O1—P1 angle is 146.39(9)°. When the molecule is viewed down the spine, the configuration of the two sets of phenyl rings is staggered, allowing for the bent Sn—O—P angle.
The molecular packing of (I) is largely devoid of directional interactions. The only notable interaction is an end-on Sn—I⋯π(phenyl) interaction [Sn—I1⋯Cg(C31—C36)i: I1⋯Cg(C31—C36)i = 3.8518(8) Å with angle at I1 = 154.14(2)° for symmetry operation (i) −1 + x, y, −1 + z]. The mode of association leads to the formation of a linear supramolecular chain along [1 0 1].
A further evaluation of the molecular packing was made by calculating the Hirshfeld surfaces and full and delineated two-dimensional fingerprint plots for (I) using Crystal Explorer 17 [11] and literature protocols [12]. The two most dominant surface contacts, comprising over 90% of all contacts, are H⋯H [64.4%] and C⋯H/H⋯C [23.1%]. The contacts involving iodide are I⋯H/H⋯I [6.9%] and I⋯C/C⋯I [2.0%], with the only remaining contacts being of the type C⋯C [0.7%].
The crystal structures of the chloride (II) [13] and bromide (III) [14] analogues of (I) are known. Crystals of the reported (I)–(III) are not isostructural. In (II), C—H⋯π(phenyl) and C—H⋯Cl contacts are noted. However, in (III), no directional interactions are apparent.
Acknowledgements
Sunway University Sdn Bhd is thanked for financial support of this work through Grant no. STR-RCTR-RCCM-001-2019.
References
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©2019 Kong Mun Lo et al., published by De Gruyter, Berlin/Boston
This work is licensed under the Creative Commons Attribution 4.0 Public License.
Articles in the same Issue
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- The crystal structure of 3-benzyl-1-((8-(benzyloxy)quinolin-2-yl)methyl)-1H-imidazol-3-ium hexafluorophosphate, C27H24N3OF6P
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- Crystal structure of catena-poly[diaqua-bis(3,4,5,6-tetrabromo-carboxybenzoato-κ1O)-(μ2-4,4′-bipyridine-κ2N:N′)cobalt(II)], C26H14Br8CoN2O10
- Crystal structure of catena-poly[dibenzyl-dichlorido-(μ2-[4,4′-bipyridine]1,1′-dioxide-κ2O:O′)tin(IV)], C24H22Cl2N2O2Sn
- Crystal structure of benzyl-chlorido-(4-chloro-N-[(2-oxidophenyl)methylidene]benzenecarbohydrazonato)-methanol-tin(IV), C22H20Cl2N2O3Sn
- Crystal structure of catena-poly[triaqua-(1,3-di(1H-imidazol-1-yl)benzene-κ2N:N′)-(3-nitrophthalato-κ1O)cobalt(II)] — water (2/3), C20H22N5O10.5Co
- Crystal structure of (3R,5R,8R,9R,10R,12R,13R,14R)-4,4,8,10,14-pentamethyl-17-((R)-2,6,6-trimethyltetrahydro-2H-pyran-2-yl)hexadecahydro-1H-cyclopenta[a]phenanthrene-3,12-diol, C30H52O3
- Crystal structure of 3-(3-(4-carboxyphenyl)ureido)pyridin-1-ium perchlorate, C26H24Cl2N6O14
- Crystal structure of 8-hydroxy-2-methylquinolin-1-ium chloride dihydrate, C10H14ClNO3
- Crystal structure of (dibenzyl sulphoxide-κO)dibromido-bis(4-bromobenzyl-κC)tin(IV), C28H26Br4OSSn
- Crystal structure of bromido-tri(4-chlorophenyl-κ1C)-(ethanol-κ1O)tin(IV) — 4,4′-dimethyl-2,2′-bipyridine (2/1), C52H48Br2Cl6N2O2Sn2
- Crystal structure of 2-butyl-6-(ethylamino)-1H-benzo[de]isoquinoline-1,3(2H)-dione, C18H20N2O2
- Crystal structure of (4-chloro-N-[(2-oxido-5-chlorophenyl)methylidene] benzene-carbohydrazonato-κ3N,O,O′)bis(2-fluorobenzyl)tin(IV), C28H20Cl2F2N2O2Sn
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- Crystal structure of catena-poly[tri(4-chlorophenyl)-(μ2-hydroxido)tin(IV)] – 2-propanol (1/1), C21H21Cl3O2Sn
- Crystal structure of bromido-dimethyl-4-tolyl-(triphenylphosphine oxide)tin(IV), C27H28BrOPSn
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- Crystal structure of 2-((2-(3-hydroxy-7-methylene-2,3-dihydro-7H-furo[3,2-g]chromen-2-yl)propan-2-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol – a marmesin derivative, C20H24O10
- Crystal structure of octa(4-chlorobenzyl)-dichlorido-bis(μ2-methanolato)-bis(μ3-oxo)-tetratin(IV), C58H54Cl10O4Sn4
- Crystal structure of iodido-triphenyl-(triphenylphosphine oxide)tin(IV), C36H30IOPSn
- Crystal structure of dichlorido-bis(4-methylphenyl-κC)-bis(triphenylarsine oxide-κO)tin(IV), C50H44As2Cl2O2Sn
- Crystal structure of 4-benzyl-1-oxo-N-phenethyl-1H-[1,4]oxazino [4,3-b]indazole-3-carboxamide, C26H21N3O3
- Crystal structure of bis{(N-[(5-chloro-2-oxidophenyl)methylidene]-2-hydroxybenzenecarbohydrazonato)-dioxo-molybdenum(VI)}(μ2-4,4′-bipyridine), C38H26Cl2Mo2N6O10
- Crystal structure of dichlorido-octamethyl-bis(μ3-oxido)-bis(μ2-2-(phenylamino)ethanolato-κ2O:O)tetratin(IV), C24H44Cl2N2O4Sn4
- The crystal structure of 1-(2-(2-(imidazo[1,5-a]pyridine-4-ium)ethoxy)ethyl)-imidazo[1,5-a]pyridine-4-ium bis(hexafluorophosphate) — acetonitrile (1/1), C18H20ON4F12P2
- Crystal structure of cyclo[tetra(μ2-cyanido)-tetracyanido-bis(1,4,7,10-tetraazacyclododecane-κ4N,N′,N′′,N′′′)dinickel(II)dipalladium(II)] hexahydrate, C24H52N16Ni2O6Pd2
- Crystal structure of (dimethyl sulfoxide)-dioxido-[2-hydroxy-N′-(4-oxo-4-phenylbutan-2-ylidene)benzohydrazidato κ3N,O,O′]molybdenum(VI), C19H20MoN2O6S
- Crystal structure of bis(acetylacetonato-κ2O,O′)-(ethanolamine-κ2N,O)copper(II), C14H25CuNO5
- Crystal structure of chlorido-diphenyl-(isopropyl(propyl)carbamodithioato-κ2S,S′)tin(IV), C19H24ClNS2Sn
- The crystal structure of bis(imidazole-1-yl)methane monohydrate, C7H10N4O
- The crystal structure of bis(4-nitroimidazole-1-1yl)methane, C7H6N6O4
- Crystal structure of di(naphthalen-2-yl)sulfane, C20H14S
- Crystal structure of 3-acetyl-6-bromo-4-hydroxy-2H-chromen-2-one, C11H7BrO4
- Crystal structure of N′2,N′6-bis((E)-1-(pyrazin-2-yl)ethylidene)pyridine-2,6-dicarbohydrazide — methanol (1/2), C21H25N9O4
- The crystal structure of 3-nitro-4-(p-tolylamino)-2H-chromen-2-one, C16H12N2O4
- The crystal structure of 1,2-bis((4-methoxyphenyl)ethynyl)benzene, C24H18O2
- Crystal structure of a low-temperature (100 K) polymorph of catena-poly[(μ2-4,4′-bipyridine-κ2N,N′)-bis(O,O′-diethyldithiophosphato-κ1S)zinc(II)], C18H28N2O4P2S4Zn
- The pseudosymmetric low temperature polymorph of catena-poly[(μ2-4,4′-bipyridyl-κN,N′)-bis(O,O′-diethyldithiophosphato-κS)-cadmium(II)], {C18H28CdN2O4P2S4}n
- Crystal structure of 3-iodophthalic acid, C8H5IO4
- The crystal structure of tert-butyl (tert-butoxy(oxo)methyl)(5-bromo-2-fluorophenyl)carbamate, C16H21BrFNO4
- The crystal structure of bis(μ2-5,7-dichloroquinolin-8-olato-κ3N,O:O)-tetrakis(5,7-dichloroquinolin-8-olato-κ2N,O)bis(methanol-κ1O)dieuropium(III) — toluene (1/1), C63H39Cl12Eu2N6O8
- Crystal structure of dichlorido-(N′-(1-(3-ethylpyrazin-2-yl)ethylidene)-4-methoxybenzohydrazide-κ3N,N′,O)cadmium(II), C16H18N4O2Cl2Cd
- A redetermination of the crystal structure of catena-poly[(bis(O,O′-isopropyl dithiophosphato-κ2S,S′)-(μ2-1,2-bis(3-pyridylmethylene)hydrazine-κ2N,N′)cadmium(II)], {C24H38CdN4O4P2S4}n
Articles in the same Issue
- 10.1515/ncrs-2020-frontmatter1
- The crystal structure of 3,5-dicarboxybenzenaminium perchlorate monohydrate, C8H8ClNO9
- The crystal structure of poly[(m4-4-bromoisophthalato-κ4O: O′:O′′:O′′′)zinc(II)], C8H3BrO4Zn
- Crystal structure of (E)-2-(2-chloro-6-hydroxybenzylidene)hydrazine-1-carbothioamide, C8H8ClN3O4S
- Crystal structure of 1,1′-methylenebis(3-ethyl-1H-imidazol-3-ium) bis(hexafluorophosphate(V)), C11H18F12N4P2
- The crystal structure of hexakis(1-isopropyl-1H-imidazole-κ1N)copper(II) dichloride, C36H58Cl2CuN12
- Crystal structure of catena-poly[μ2-4,4′-bipyridine-κ2N:N′)-tetrakis(μ2-2-((3,5,6-trichloropyridin-2-yl)oxy)acetato-κ2O:O′)dicobalt(II)], C19H10Cl6CoN3O6
- Crystal structure of (E)-1-(4-(((E)-2-bromo-6-hydroxybenzylidene)amino)phenyl)ethan-1-one O-methyl oxime, C16H15BrN2O2
- Crystal structure of ethyl 2-methyl-4-(5-methylthiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, C18H21NO3S
- The crystal structure of 5-bromo-2-(1-methyl-1H-tetrazol-5-yl)pyridine, C7H6BrN5
- Crystal structure of Bis(acetato-κ2O,O′)-bis[4-(dimethylamino)pyridine-κN]nickel(II), C18H26N4NiO4
- Crystal structure of (E)-3-chloro-2-(((4-chlorophenyl)imino)methyl)phenol, C13H9Cl2NO
- The co-crystal structure of (17b)-estra-1,3,5(10)-triene-3,17diol – acetamide (1/1), a Z′ = 4 structure, C20H29NO3
- Crystal structure of 3-(3-(pyridin-3-yl)ureido)benzoic acid, C13H11N3O3
- The crystal structure of 1,1′-(9-ethyl-9H-carbazole-3,6-diyl)bis(3-ethyl-1H-imidazol-3-ium) bis(hexafluorophosphate(IV)), C24H27N5F12P2
- The crystal structure of 2-bromoisophthalic acid, C8H5BrO4
- The crystal structure of 13-ethoxycarbonyl-9-methyl-4-chlor-11-thioxo-8-oxa-10,12-diazatricyclo[7.3.1.02,7]trideca-2,4,6-triene, C14H15ClN2O3S
- The crystal structure of (E)-4-((4-(diethylamino)benzylidene)amino)-N,N-diphenylaniline, C29H29N3
- Crystal structure of 2-(3-(2-(4-phenylpiperazin-1-yl)ethyl)benzyl)isoindoline-1,3-dione, C27H27N3O2
- Crystal structure of 2-ethoxy-6-((E)-((3-(((E)-3-ethoxy-2-hydroxybenzylidene)amino)-2-hydroxypropyl)iminio)methyl)phenolate, C21H26N2O5
- The crystal structure of catena-poly(μ2-4,4′-bipyridine-κ2N:N′)-tetrakis(μ2-2-((3,5,6-trichloropyridin-2-yl)oxy)acetato-κ2O:O′)dinickel(II)], C19H10Cl6N3NiO6
- Crystal structure of hexakis(μ2-azido-κ2N:N)-diazido-κ1N-tetrakis(phenanthroline-κ2N,N′)tetrazinc(II), C48H32N32Zn4
- Synthesis and crystal structure of bis{2-bromo-6-(((4-(1-(methoxyimino)ethyl)phenyl)imino)methyl)phenolato-κ2N,O}cobalt(II)–dichloromethane(1/1), C34H32Br2Cl4CoN4O4
- Crystal structure of (E)-3-chloro-2-(((4-nitrophenyl)imino)methyl)phenol, C13H9ClN2O3
- Crystal structure of aqua-bis(5-bromo-6-methyl-picolinato-κ2N,O)zinc(II) dihydrate, C14H16Br2N2O7Zn
- Crystal structure of biaqua(2,2′-bipyridine-4,4′-dicarboxylato-κ2N,N′)(pyridine-2,6-dicarboxylato-κ3O,N,O′)nickel(II) hydrate, C19H15N3NiO10
- Synthesis and crystal structure of bis(2-(((4-(1-(ethoxyimino)ethyl)phenyl)imino)methyl)-5-fluorophenolato-κ2N,O)zinc(II) - methanol (1/1), C33H32F2N4O4Zn
- Crystal structure of tetraaqua-bis(μ2-5-aminoisophthalato-κ3N:O,O′)-bis(4,4′-dipyridylsulfide-κ1N)dizinc(II), C36H34N6O12S2Ni2
- Crystal structure of (1,4,8,11-tetraazacyclotetradecane-κ4N,N′,N′′,N′′′)palladium(II) tetracyanonickelate(II), C14H24N8NiPd
- The crystal structure of 3-benzyl-1-((8-(benzyloxy)quinolin-2-yl)methyl)-1H-imidazol-3-ium hexafluorophosphate, C27H24N3OF6P
- Crystal structure of 1-(4-chloro-2-hydroxy-5-iodophenyl)ethan-1-one, C8H6ClIO2
- Crystal structure of hexaaquamagnesium(II) bis((E)-4-((4-(dimethylamino)phenyl)diazenyl)benzenesulfonate), C28H40MgN6O12S2
- Crystal structure of the coordination polymer catena-poly[(1,2-di(pyridin-4-yl)ethane-κN)-(μ2-2-nitroisophthalato-κ2O:O′)zinc(II)], C20H17N3O7Zn
- Crystal structure of catena-{[tri-aqua-di-sodium bis(2-{[n-butyl(methyl)carbamothioyl]sulfanyl}acetate)]}n, [C16H34N2Na2O7S4]n
- The crystal structure of diaqua-bis(μ2-3-((3-acetyl-5-carboxyphenyl)oxidophosphoryl)-5-carboxybenzoato-κ2O:O′)bis(5,5′-dimethyl-2,2′-bipyridine-k2N,N′)zinc(II), C56H46N4O22P2Zn2
- Crystal structure of N′,2-bis((E)-2-chloro-6-hydroxybenzylidene)hydrazine-1-carbothiohydrazide, C15H12Cl2N4O2S
- Crystal structure of 2-[(1E)-{[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]iminiumyl}methyl]-5-(dodecyloxy)benzen-1-olate, C23H39NO5
- Crystal structure of 12-(2-hydroxybenzoyl)benzo[f]pyrido[1,2-a]indole-6,11-dione, C23H13NO4
- Crystal structure of chlorido-(4-chloro-6-(p-tolyl)pyrimidine-κ2C,N)-(triphenylphosphane-κP)palladium(II), C29H23Cl2N2PPd
- Crystal structure of catena-poly[diaqua-bis(3,4,5,6-tetrabromo-carboxybenzoato-κ1O)-(μ2-4,4′-bipyridine-κ2N:N′)cobalt(II)], C26H14Br8CoN2O10
- Crystal structure of catena-poly[dibenzyl-dichlorido-(μ2-[4,4′-bipyridine]1,1′-dioxide-κ2O:O′)tin(IV)], C24H22Cl2N2O2Sn
- Crystal structure of benzyl-chlorido-(4-chloro-N-[(2-oxidophenyl)methylidene]benzenecarbohydrazonato)-methanol-tin(IV), C22H20Cl2N2O3Sn
- Crystal structure of catena-poly[triaqua-(1,3-di(1H-imidazol-1-yl)benzene-κ2N:N′)-(3-nitrophthalato-κ1O)cobalt(II)] — water (2/3), C20H22N5O10.5Co
- Crystal structure of (3R,5R,8R,9R,10R,12R,13R,14R)-4,4,8,10,14-pentamethyl-17-((R)-2,6,6-trimethyltetrahydro-2H-pyran-2-yl)hexadecahydro-1H-cyclopenta[a]phenanthrene-3,12-diol, C30H52O3
- Crystal structure of 3-(3-(4-carboxyphenyl)ureido)pyridin-1-ium perchlorate, C26H24Cl2N6O14
- Crystal structure of 8-hydroxy-2-methylquinolin-1-ium chloride dihydrate, C10H14ClNO3
- Crystal structure of (dibenzyl sulphoxide-κO)dibromido-bis(4-bromobenzyl-κC)tin(IV), C28H26Br4OSSn
- Crystal structure of bromido-tri(4-chlorophenyl-κ1C)-(ethanol-κ1O)tin(IV) — 4,4′-dimethyl-2,2′-bipyridine (2/1), C52H48Br2Cl6N2O2Sn2
- Crystal structure of 2-butyl-6-(ethylamino)-1H-benzo[de]isoquinoline-1,3(2H)-dione, C18H20N2O2
- Crystal structure of (4-chloro-N-[(2-oxido-5-chlorophenyl)methylidene] benzene-carbohydrazonato-κ3N,O,O′)bis(2-fluorobenzyl)tin(IV), C28H20Cl2F2N2O2Sn
- Crystal structure of aqua-chlorido-(4-fluorobenzyl-κC)-(N′-(4-methoxy-2-oxidobenzylidene)-3-hydroxy-2-naphthohydrazidato-κ3N,O,O′)tin(IV), C26H22ClFN2O5Sn
- Crystal structure of catena-poly[tri(4-chlorophenyl)-(μ2-hydroxido)tin(IV)] – 2-propanol (1/1), C21H21Cl3O2Sn
- Crystal structure of bromido-dimethyl-4-tolyl-(triphenylphosphine oxide)tin(IV), C27H28BrOPSn
- Crystal structure of 2-(bis(2-hydroxyethyl)ammonio)ethane-1-sulfonate, C6H15NO5S
- Crystal structure of bis[triaqua-(μ2-1,2-di(4-pyridyl)ethylene-κ2N:N′)-(4-sulfonatobenzoato-κ2O,O′)zinc(II)], C13H15NO8SZn
- Crystal structure of 2-((2-(3-hydroxy-7-methylene-2,3-dihydro-7H-furo[3,2-g]chromen-2-yl)propan-2-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol – a marmesin derivative, C20H24O10
- Crystal structure of octa(4-chlorobenzyl)-dichlorido-bis(μ2-methanolato)-bis(μ3-oxo)-tetratin(IV), C58H54Cl10O4Sn4
- Crystal structure of iodido-triphenyl-(triphenylphosphine oxide)tin(IV), C36H30IOPSn
- Crystal structure of dichlorido-bis(4-methylphenyl-κC)-bis(triphenylarsine oxide-κO)tin(IV), C50H44As2Cl2O2Sn
- Crystal structure of 4-benzyl-1-oxo-N-phenethyl-1H-[1,4]oxazino [4,3-b]indazole-3-carboxamide, C26H21N3O3
- Crystal structure of bis{(N-[(5-chloro-2-oxidophenyl)methylidene]-2-hydroxybenzenecarbohydrazonato)-dioxo-molybdenum(VI)}(μ2-4,4′-bipyridine), C38H26Cl2Mo2N6O10
- Crystal structure of dichlorido-octamethyl-bis(μ3-oxido)-bis(μ2-2-(phenylamino)ethanolato-κ2O:O)tetratin(IV), C24H44Cl2N2O4Sn4
- The crystal structure of 1-(2-(2-(imidazo[1,5-a]pyridine-4-ium)ethoxy)ethyl)-imidazo[1,5-a]pyridine-4-ium bis(hexafluorophosphate) — acetonitrile (1/1), C18H20ON4F12P2
- Crystal structure of cyclo[tetra(μ2-cyanido)-tetracyanido-bis(1,4,7,10-tetraazacyclododecane-κ4N,N′,N′′,N′′′)dinickel(II)dipalladium(II)] hexahydrate, C24H52N16Ni2O6Pd2
- Crystal structure of (dimethyl sulfoxide)-dioxido-[2-hydroxy-N′-(4-oxo-4-phenylbutan-2-ylidene)benzohydrazidato κ3N,O,O′]molybdenum(VI), C19H20MoN2O6S
- Crystal structure of bis(acetylacetonato-κ2O,O′)-(ethanolamine-κ2N,O)copper(II), C14H25CuNO5
- Crystal structure of chlorido-diphenyl-(isopropyl(propyl)carbamodithioato-κ2S,S′)tin(IV), C19H24ClNS2Sn
- The crystal structure of bis(imidazole-1-yl)methane monohydrate, C7H10N4O
- The crystal structure of bis(4-nitroimidazole-1-1yl)methane, C7H6N6O4
- Crystal structure of di(naphthalen-2-yl)sulfane, C20H14S
- Crystal structure of 3-acetyl-6-bromo-4-hydroxy-2H-chromen-2-one, C11H7BrO4
- Crystal structure of N′2,N′6-bis((E)-1-(pyrazin-2-yl)ethylidene)pyridine-2,6-dicarbohydrazide — methanol (1/2), C21H25N9O4
- The crystal structure of 3-nitro-4-(p-tolylamino)-2H-chromen-2-one, C16H12N2O4
- The crystal structure of 1,2-bis((4-methoxyphenyl)ethynyl)benzene, C24H18O2
- Crystal structure of a low-temperature (100 K) polymorph of catena-poly[(μ2-4,4′-bipyridine-κ2N,N′)-bis(O,O′-diethyldithiophosphato-κ1S)zinc(II)], C18H28N2O4P2S4Zn
- The pseudosymmetric low temperature polymorph of catena-poly[(μ2-4,4′-bipyridyl-κN,N′)-bis(O,O′-diethyldithiophosphato-κS)-cadmium(II)], {C18H28CdN2O4P2S4}n
- Crystal structure of 3-iodophthalic acid, C8H5IO4
- The crystal structure of tert-butyl (tert-butoxy(oxo)methyl)(5-bromo-2-fluorophenyl)carbamate, C16H21BrFNO4
- The crystal structure of bis(μ2-5,7-dichloroquinolin-8-olato-κ3N,O:O)-tetrakis(5,7-dichloroquinolin-8-olato-κ2N,O)bis(methanol-κ1O)dieuropium(III) — toluene (1/1), C63H39Cl12Eu2N6O8
- Crystal structure of dichlorido-(N′-(1-(3-ethylpyrazin-2-yl)ethylidene)-4-methoxybenzohydrazide-κ3N,N′,O)cadmium(II), C16H18N4O2Cl2Cd
- A redetermination of the crystal structure of catena-poly[(bis(O,O′-isopropyl dithiophosphato-κ2S,S′)-(μ2-1,2-bis(3-pyridylmethylene)hydrazine-κ2N,N′)cadmium(II)], {C24H38CdN4O4P2S4}n