scholarly journals Crystal structure of tris[μ2-bis(diphenylphosphanyl)methane-κ2P:P′]di-μ3-iodido-trisilver(I) iodide–N-phenylthiourea (1/1)

2015 ◽  
Vol 71 (11) ◽  
pp. m187-m188 ◽  
Author(s):  
Yupa Wattanakanjana ◽  
Arunpatcha Nimthong-Roldán ◽  
Suthida Palavat ◽  
Walailak Puetpaiboon
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Title Complex ◽  
Tetrahedral Geometry ◽  
Distorted Tetrahedral Geometry ◽  
Phenyl Rings ◽  
Graph Set

The title complex, [Ag3I2(C25H22P2)3]I·C7H8N2S, comprises a trinuclear [Ag3I2(C25H22P2)3]+unit, an I−anion and oneN,N′-phenylthiourea molecule (ptu). Two μ3-bridging I−anions are linked by three AgIions, leading to the formation of a dicapped triangular motif with Ag...Ag separations in the range 3.0823 (5)–3.2999 (5) Å. Each AgIatom exhibits a distorted tetrahedral geometry, with coordination to two I atoms and two P atoms from bis(diphenylphosphanyl)methane ligands. In the crystal, the I−anion is linked to the ptu molecule through two N—H...I hydrogen bonds [graph-set motifR21(6)]. These N—H...I hydrogen bonds, in addition to weak C—H...S and C—H...I hydrogen bonds, form zigzag chains along [010]. Two of the phenyl rings of two dppm ligands are disordered over two sets of sites with refined occupancies of 0.557 (16) and 0.443 (16).

[μ-10,21-Difluoro-3,6,14,17-tetrazatricyclo[17.3.1.18,12]tetracosa-1(23),2,6,8,10,12(24),13,17,19,21-decaene-23,24-diolato-κ4 N 3,N 6,O 23,O 24:κ4 N 14,N 17,O 23,O 24]bis[methanolcopper(II)] bis(perchlorate)

2007 ◽  
Vol 63 (11) ◽  
pp. m2641-m2641 ◽  
Author(s):  
Jun-Lin Bai ◽  
Hong Zhou ◽  
Zhi-Quan Pan ◽  
Xiang-Gao Meng
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Copper Complex ◽  
Title Complex ◽  
Tetrahedral Geometry ◽  
Intramolecular Hydrogen Bonds ◽  
Dinuclear Copper ◽  
Distorted Tetrahedral Geometry ◽  
O 24 ◽  
Intramolecular Hydrogen

The title complex, [Cu2(C20H16F2N4O2)(CH4O)2](ClO4)2, was synthesized by cyclo-condensation between ethylenediamine and 2,6-diformyl-4-fluorophenol in the presence of CuII ions. This dinuclear copper complex is centrosymmetric. Both Cu atoms are in a distorted tetrahedral geometry, coordinated by three O atoms and two N atoms. The two Cu atoms are bridged by two endogenous phenol O atoms, with a Cu...Cu distance of 2.8998 (7) Å. In the crystal structure, the perchlorate ions link the macrocycles through inter- and intramolecular hydrogen bonds.

scholarly journals Crystal structure of bis[2-(benzothiazol-2-yl)phenolato-κ2N,O]copper(II)

2015 ◽  
Vol 71 (9) ◽  
pp. m173-m174 ◽  
Author(s):  
Namhun Kim ◽  
Sung Kwon Kang
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Dihedral Angle ◽  
Title Complex ◽  
Dihedral Angles ◽  
Planar Geometry ◽  
Supramolecular Network ◽  
Two Dimensional ◽  
Tetrahedral Geometry ◽  
Distorted Tetrahedral Geometry

In the title complex, [Cu(C13H8NOS)2], the CuIIatom is coordinated by two N atoms and two O atoms from two bidentate benzothiazolphenolate ligands, forming a distorted tetrahedral geometry [dihedral angle between two N—Cu—O planes: 45.1 (2)°]. The dihedral angles between the benzothiazole ring systems and the phenol rings are 4.1 (4) and 5.8 (4)°, indicating an almost planar geometry. Weak intra- and intermolecular C—H...O hydrogen bonds are observed. In the crystal, weak π–π interactions between aromatic and thiazole rings [centroid–centroid distances = 3.626 (3) and 3.873 (3) Å] link the molecules into a two-dimensional supramolecular network along thebcplane.

scholarly journals Bis(4,6-di-tert-butyl-2-{N-[4-(diethylamino)phenyl]carboximidoyl}phenolato)cobalt(II)

IUCrData ◽  
2017 ◽  
Vol 2 (6) ◽  
Author(s):  
C.Vidya Rani ◽  
L. Mitu ◽  
G. Chakkaravarthi ◽  
G. Rajagopal
Keyword(s):  
Molecular Structure ◽  
Hydrogen Bonds ◽  
Crystal Packing ◽  
Title Complex ◽  
Dihedral Angles ◽  
Minor Components ◽  
Tetrahedral Geometry ◽  
Acta Cryst ◽  
Distorted Tetrahedral Geometry ◽  
Benzene Rings

In the title complex, [Co(C25H35N2O)2], the cobalt(II) atom has a distorted tetrahedral geometry provided by pairs of O and N atoms. The dihedral angles between the benzene rings of the same ligand are 52.39 (9) and 34.96 (9)°. The molecular structure is stabilized by weak intramolecular C—H...O hydrogen bonds. The crystal packing is stabilized mainly by van der Waals forces. The structure contains a solvent-accessible void of 276 Å3which was treated using the SQUEEZE routine fromPLATON[Spek (2015).Acta Cryst.C71, 9–18]. The methyl C atoms of thetert-butyl groups are rotationally disordered, with site occupancies of 0.802 (3) and 0.548 (9) for the major components and 0.198 (3) and 0.452 (9) for the minor components.

scholarly journals Bis(N′-{(E)-[(2E)-1,3-diphenylprop-2-en-1-ylidene]amino}-N-ethylcarbamimidothioato-κ2N′,S)zinc(II): crystal structure and Hirshfeld surface analysis

2017 ◽  
Vol 73 (7) ◽  
pp. 1001-1008 ◽  
Author(s):  
Ming Yueh Tan ◽  
Karen A. Crouse ◽  
Thahira B. S. A. Ravoof ◽  
Mukesh M. Jotani ◽  
Edward R. T. Tiekink
Keyword(s):  
Hydrogen Bonds ◽  
Three Dimensional ◽  
Asymmetric Unit ◽  
Tetrahedral Geometry ◽  
Π Interactions ◽  
Distorted Tetrahedral Geometry ◽  
Hirshfeld Surfaces ◽  
Phenyl Rings ◽  
The Impact ◽  
Dimeric Aggregates

The title ZnIIcomplex, [Zn(C18H18N3S)2], (I), features two independent but chemically equivalent molecules in the asymmetric unit. In each, the thiosemicarbazonate monoanion coordinates the ZnIIatomviathe thiolate-S and imine-N atoms, with the resulting N2S2donor set defining a distorted tetrahedral geometry. The five-membered ZnSCN2chelate rings adopt distinct conformations in each independent molecule,i.e.one ring is almost planar while the other is twisted about the Zn—S bond. In the crystal, the two molecules comprising the asymmetric unit are linked by amine-N—H...N(imine) and amine-N—H...S(thiolate) hydrogen bondsviaan eight-membered heterosynthon, {...HNCN...HNCS}. The dimeric aggregates are further consolidated by benzene-C—H...S(thiolate) interactions and are linked into a zigzag supramolecular chain along thecaxisviaamine-N—H...S(thiolate) hydrogen bonds. The chains are connected into a three-dimensional architectureviaphenyl-C—H...π(phenyl) and π–π interactions, the latter occurring between chelate and phenyl rings [inter-centroid separation = 3.6873 (11) Å]. The analysis of the Hirshfeld surfaces calculated for (I) emphasizes the different interactions formed by the independent molecules in the crystal and the impact of the π–π interactions between chelate and phenyl rings.

scholarly journals Poly[(μ2-benzene-1,3-dicarboxylato-κ2 O 1:O 3){μ2-1,2-bis[(1H-imidazol-1-yl)methyl]benzene-κ2 N 3:N 3′}zinc]

2012 ◽  
Vol 68 (6) ◽  
pp. m826-m826
Author(s):  
Hong Chen ◽  
Heng Xu
Keyword(s):  
Crystal Structure ◽  
Coordination Polymer ◽  
Hydrogen Bonds ◽  
Layer Structure ◽  
Dihedral Angles ◽  
Two Dimensional ◽  
Neutral Ligand ◽  
Tetrahedral Geometry ◽  
Distorted Tetrahedral Geometry ◽  
Methyl Benzene

In the two-dimensional title coordination polymer, [Zn(C8H4O4)(C14H14N4)] n , the ZnII atom adopts a distorted tetrahedral geometry, being ligated by two O atoms from two different benzene-1,3-dicarboxylate dianions and two N atoms from two symmetry-related 1,2-bis(imidazol-1-ylmethyl)benzene molecules. The dihedral angles between the imidazole rings and the benzene ring in the neutral ligand are 76.31 (13) and 85.33 (15)°. The ZnII atoms are bridged by dicarboxylate ligands, forming chains parallel to the a axis, which are further linked by 1,2-bis(imidazol-1-ylmethyl)benzene molecules, generating a two-dimensional layer structure parallel to the ac plane. The crystal structure is enforced by intralayer and interlayer C—H...O hydrogen bonds.

scholarly journals Bis(2-amino-3-methylpyridine-κN1)dichloridomercury(II)

2012 ◽  
Vol 68 (8) ◽  
pp. m1099-m1099 ◽  
Author(s):  
Azadeh Tadjarodi ◽  
Keyvan Bijanzad ◽  
Behrouz Notash
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bond ◽  
Hydrogen Bonds ◽  
Title Compound ◽  
Rotation Axis ◽  
Complex Molecule ◽  
Tetrahedral Geometry ◽  
Distorted Tetrahedral Geometry

In the title compound, [HgCl2(C6H8N2)2], the two independent HgIIcations are each located on a twofold rotation axis and coordinated by two pyridine N atoms from two 2-amino-3-methylpyridine ligands and two Cl−anions in a distorted tetrahedral geometry. An intramolecular N—H...Cl hydrogen bond occurs in each independent complex molecule. Intermolecular N—H...Cl hydrogen bonds occur in the crystal structure.

scholarly journals catena-Poly[(chloridozinc)-μ-5-(1-methyl-1H-benzimidazol-2-yl-κN3)-1,2,3-triazol-1-ido-κ2N1:N3]

2012 ◽  
Vol 68 (4) ◽  
pp. m520-m520
Author(s):  
Chen-Guang Sun ◽  
Ji-Rong Song
Keyword(s):  
Hydrogen Bonds ◽  
Three Dimensional ◽  
Title Complex ◽  
Helical Chain ◽  
Supramolecular Network ◽  
Tetrahedral Geometry ◽  
Distorted Tetrahedral Geometry ◽  
Centroid Distance ◽  
Cl Atom

In the title complex, [Zn(C10H8N5)Cl]n, the ZnIIion is four-coordinated by one Cl atom and three N atoms from twoin situ-generated deprotonated 5-(1-methyl-1H-benzimidazol-2-yl-κN3)-1,2,3-triazol-1-ide ligands in a slightly distorted tetrahedral geometry. The ZnIIions are bridged by the ligands, forming a helical chain along [001]. C—H...N and C—H...Cl hydrogen bonds and π–π interactions between the imidazole rings [centroid–centroid distance = 3.4244 (10) Å] assemble the chains into a three-dimensional supramolecular network.

scholarly journals Chlorido[5-methoxy-1H-benzimidazole-2(3H)-thione-κS]bis(triphenylphosphane-κP)copper(I) methanol disolvate

2014 ◽  
Vol 70 (2) ◽  
pp. m269-m269
Author(s):  
Qing-Xuan Meng
Keyword(s):  
Hydrogen Bond ◽  
Hydrogen Bonds ◽  
Short Distance ◽  
Structural Unit ◽  
Chloride Anion ◽  
Title Complex ◽  
Tetrahedral Geometry ◽  
Complex Molecules ◽  
Distorted Tetrahedral Geometry ◽  
Solvent Molecules

In the title complex, [CuCl(C8H8N2OS)(C18H15P)2]·2CH3OH, the CuIion is coordinated by one chloride anion, one S atom from the 5-methoxy-1H-benzimidazole-2(3H)-thione ligand and two P atoms from two triphenylphosphine ligands in a distorted tetrahedral geometry. One of the N-bound H atoms is involved in an intramolecular N—H...Cl hydrogen bond, while another one interacts with the solvent methanol moleculeviaan N—H...O hydrogen bond. Intermolecular O—H...Cl and O—H...O hydrogen bonds link two further complex molecules and four solvent molecules into a centrosymmetric structural unit. The short distance of 3.624 (4) Å between the centroids of the five- and the six-membered rings of two benzimidazole fragments indicates the presence of π–π interactions.

scholarly journals Crystal structure of 3-[4-(benzyloxy)phenyl]-2,3-dihydro-1H-benzo[f]chromen-1-one

2014 ◽  
Vol 70 (10) ◽  
pp. o1116-o1117 ◽  
Author(s):  
R. Vasanthi ◽  
D. Reuben Jonathan ◽  
K. S. Ezhilarasi ◽  
S. Sathya ◽  
G. Usha
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Chair Conformation ◽  
Ring System ◽  
Dihedral Angles ◽  
Naphthalene Ring ◽  
Pyran Ring ◽  
Compound C ◽  
Phenyl Rings ◽  
Graph Set

In the title compound, C26H20O3, the pyran ring has a distorted half-chair conformation and its mean plane is inclined to the naphthalene ring system, to which it is fused, by 10.79 (9)°. The dihedral angles between the napthalene unit and the benzene and phenyl rings are 54.39 (9) and 52.65 (12)°, respectively, while the benzene and phenyl rings are inclined to one another by 74.80 (14)°. There is a short C—H...O contact in the chromen-1-one unit. In the crystal, molecules are linked by two pairs of C—H...O hydrogen bonds, forming inversion dimers described by graph set motifsR22(8) andR22(10), giving rise to chains running parallel to (101). The chains are linkedviaC—H...π interactions, forming sheets lying parallel to (010).

scholarly journals Crystal structure of bis(thiourea-κS)bis(triphenylphosphane-κP)silver(I) nitrate

2015 ◽  
Vol 71 (2) ◽  
pp. 220-222 ◽  
Author(s):  
Sidra Nawaz ◽  
Muhammad Nawaz Tahir ◽  
Muhammad Amir Nadeem ◽  
Bushra Mehmood ◽  
Saeed Ahmad
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Tetrahedral Geometry ◽  
Bond Angles ◽  
Distorted Tetrahedral Geometry

In the title salt, [Ag(CH4N2S)2(PPh3)2]NO3, the AgIatom is coordinated by two thiourea S atoms and two triphenylphosphane P atoms in a distorted tetrahedral geometry, with bond angles in the range 102.90 (4)–123.29 (4)°. The Ag—S=C bond angles are 101.75 (19) and 111.29 (18)°. In the crystal, the component ions are linked by C—H...O, C—H...S, N—H...O and N—H...S hydrogen bonds, generating (10-1) sheets.

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