نتایج جستجو برای: disordered atoms

تعداد نتایج: 87941  

2010
Rosenani A. Haque Mohammed Z. Ghdhayeb Hassan H. Abdallah Ching Kheng Quah Hoong-Kun Fun

In the title compound, C(20)H(24)N(4) (2+)·2PF(6) (-), the ethene and 3-allyl-imidazolium moieties of the cation are disordered over two positions with refined site occupancies of 0.664 (19):0.336 (19) and 0.784 (7):0.216 (7), respectively, whereas four F atoms of one hexa-fluoridophosphate anion and all atoms in the other hexa-fluoridophosphate anion are disordered over two positions with refi...

2015
Shimelis T. Hailu Ray J. Butcher Paul F. Hudrlik Anne M Hudrlik

The title compound, 5(2)-[(5-bromo-pent-yl)-oxy]-1(2),1(14),3(5),5(5)-tetra-tert-butyl-1(7),1(8),1(9),1(10)-tetra-hydro-1(6) H,1(16) H-1(4,12)-dibenzo[b,e][1,7]dioxa-cyclo-dodecina-3,5(1,3)-dibenzena-cyclo-hexa-phan-3(2)-ol, C54H73BrO4, was synthesized from the reaction of tert-butyl-calix[4]arene with 1,5-di-bromo-pentane using K2CO3 in CH3CN. The structure consists of a calixarene unit with a...

2017
Serigne Fallou Pouye Ibrahima Cisse Libasse Diop Alessandro Dolmella Sylvain Bernès

In the previously reported [C2O4(SnPh3)2] complex [Diop et al. (2003 ▸). Appl. Organomet. Chem.17, 881-882.], the SnIV atoms are able to formally complete their coordination by addition of dimethyl sulfoxide (DMSO) mol-ecules provided by the reaction medium, affording the title complex, [Sn2(C6H5)6(C2O4)(C2H6OS)2]. The SnIV atoms are then penta-coordinated, with a common trans trigonal-bipyrami...

2010
Yip-Foo Win Chen-Shang Choong Sie-Tiong Ha Jia Hao Goh Hoong-Kun Fun

The title complex, [Sn(4)(C(4)H(9))(8)(C(7)H(3)ClNO(4))(4)O(2)], is a cluster formed by a crystallographic inversion center around the central Sn(2)O(2) ring. Both of the two independent Sn atoms are five-coordinated, with distorted trigonal-bipyramidal SnC(2)O(3) geometries. One Sn atom is coordinated by two butyl groups, one O atom of the benzoate anion and two bridging O atoms, whereas the o...

2010
Jia-Zhen Ge Min-Min Zhao Ping-Ping Shi

The reaction of dimethyl-amine, 18-crown-6, and perchloric acid in methanol yields the title compound, C(2)H(8)N(+)·ClO(4) (-)·C(12)H(24)O(6)·H(2)O. The dimethyl-ammonium cation and the water mol-ecule inter-act with the 18-crown-6 unit: N-H⋯O hydrogen bonds are formed between the ammonium NH(2) (+) group and four O atoms of the crown ether, while the water mol-ecule on the other side of 18-cro...

2009
Li-Cai Zhu

In the title three-dimensional heterometallic complex, {[AgDy(C(6)H(4)NO(2))(2)(C(2)H(3)O(2))(H(2)O)]ClO(4)}(n), the Dy(III) ion is eight-coordinated by four O atoms from four different isonicotinate ligands, three O atoms from two different acetate ligands and one O atom of water mol-ecule. The two-coordinate Ag(I) ion is bonded to two N atoms from two different isonicotinate anions. These met...

1998
Pedro de Vries

Resonant classical light scattering by impurity atoms inside dielectric cubic lattices is investigated in the point-dipole limit. Modifications to resonance frequencies and linewidths are shown to be different for substitutional and interstitial impurities. Spontaneous emission rates inside dielectrics exhibit the well-known empty-cavity and Lorentz local-field factors for substitutional and in...

2009
Kong Mun Lo Seik Weng Ng

The Sn atom in the title salt, (C(7)H(11)N(2))(2)[SnBr(4.67)Cl(1.33)], lies on a center of symmetry within an octa-hedron of disordered halogen atoms. The three independent halogen atoms are each a mixture of bromine and chlorine atoms [with site occupancies for bromine of 0.614 (1), 0.831 (1) and 0.888 (1)]. An N-H⋯ hydrogen bond is present.

2009
Graeme J. Gainsford Tim Kemmitt

The title compound, [Na(C(16)H(36)BO(4))](n), has a fourfold axis passing through the Na and B atoms which both are bound by four O atoms. The tetra-butoxy-borate anion provides the bridging to form one-dimensional polymers running along [001], just like those found for the tetra-ethoxy-borate structure. The two but-oxy 'tail' atoms are disordered over two conformations in a 0.887 (9):0.113 (9)...

2013
P. Narayanan Jayabal Kamalraja Paramasivam T. Perumal K. Sethusankar

In the title compound, C16H15BrN2O4, the six-membered carbocyclic ring of the chromene moiety adopts an envelope conformation with the disordered methyl-ene C atom as the flap. The pyran ring is almost orthogonal to the chloro-phenyl ring, making a dihedral angle of 87.11 (12)°. The amine-group N atom deviates significantly from the pyran ring [0.238 (3) Å]. The mol-ecular structure is stabiliz...

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