Theoretical study of structural properties and dissociation pathways of FCN and CICNBHATTACHARYYA, I; BERA, N. C; DAS, A. K et al.The European physical journal. D, Atomic, molecular and optical physics (Print). 2007, Vol 42, Num 2, pp 221-226, issn 1434-6060, 6 p.Article

Synthesis, structure, and aromaticity of a hoop-shaped cyclic benzenoid [10]cyclophenaceneNAKAMURA, Eiichi; TAHARA, Kazukuni; MATSUO, Yutaka et al.Journal of the American Chemical Society. 2003, Vol 125, Num 10, pp 2834-2835, issn 0002-7863, 2 p.Article

Electron correlation effects on structural and cohesive properties of closo-hydroborate dianions (B_nH_n)^2- (n = 5-12) and B₄H₄KALVODA, Simon; PAULUS, Beate; DOLG, Michael et al.PCCP. Physical chemistry chemical physics (Print). 2001, Vol 3, Num 4, pp 514-522, issn 1463-9076Article

Attempts to model neutral solitons in polyacetylene by ab initio and density functional methods. The nature of the spin distribution in polyenyl radicalsBALLY, T; HROVAT, D. A; BORDEN, W. T et al.PCCP. Physical chemistry chemical physics (Print). 2000, Vol 2, Num 15, pp 3363-3371, issn 1463-9076Article

Crystal structure, conformational analyses, and charge density distributions for ent-epifisetinidol : an explanation for regiospecific electrophilic aromatic substitution of 5-deoxyflavansTOBIASON, F. L; FRONCZEK, F. R; STEYNBERG, J. P et al.Tetrahedron (Oxford. Print). 1993, Vol 49, Num 27, issn 0040-4020, V, 5927-5940 [15 p.]Article

A comparison of the structure of N-chloroacetylindigo (N-chloroacetyl-2,2'-bi-indolinylidene-3,3'-dione) and N,N'-bis(chloroacetyl)indigo [N,N'-bis(chloroacetyl)-2,2'-bi-indolinylidene-3,3'-dione] in the solid and solution stateSMITH, B. D; PAUGAM, M.-F; HALLER, K. J et al.Perkin transactions. 2. 1993, Num 2, pp 165-169, issn 0300-9580Article

Bimetallic lanthanide complexes with lanthanide-transition metal bonds. Molecular structure of (C4H8O)(C5H5)2Lu-Ru(CO)2(C5H5). The use of 139La NMR spectroscopyBELETSKAYA, I. P; VOSKOBOYNIKOV, A. Z; CHUKLANOVA, E. B et al.Journal of the American Chemical Society. 1993, Vol 115, Num 8, pp 3156-3166, issn 0002-7863Article

Conformational analysis. XX: 2-bromoethanol and 2-iodoethanol. Structures, compositions, and anti-gauche energy and entropy differences from electron diffraction and structures and vibrational wavenumbers from an ab initio calculationTHOMASSEN, H; SAMDAL, S; HEDBERG, K et al.Journal of physical chemistry (1952). 1993, Vol 97, Num 16, pp 4004-4010, issn 0022-3654Article

Determination of the structure and configuration of 16α-fluoro-5-androsten-17-one by NMR spectroscopy and X-ray diffractionGARCIA-MARTINEZ, C; JOSEPH-NATHAN, P.Spectroscopy letters. 1993, Vol 26, Num 7, pp 1171-1180, issn 0038-7010Article

Supersilyl compounds (R₃,Si)₃SiSi(SiR₃)₃ and (R₃Si)₃SiC₆H₄Si(SiR₃)₃ : structures and propertiesBOCK, H; MEURET, J; RUPPERT, K et al.Angewandte Chemie. International edition in English. 1993, Vol 32, Num 3, pp 414-416, issn 0570-0833Article

The Exo-anomeric effect does not govern the conformation of some 2,2'-O-substituted α,α'-trehalose derivatives. Solid state and solution evidencesCANO, F. H; DE PAZ, J. L. G; FOCES-FOCES, C et al.Tetrahedron (Oxford. Print). 1993, Vol 49, Num 10, pp 2109-2114, issn 0040-4020Article

Inductive and steric effects on the structure of isopropyl acetate. Gas electron diffraction and ab initio MO investigationsTAKEUCHI, H; SUGINO, M; EGAWA, T et al.Journal of physical chemistry (1952). 1993, Vol 97, Num 29, pp 7511-7515, issn 0022-3654Article

Molecular structure and charge distribution in organometallics of the 4f and 5f elements. V: Crystal and molecular structure of tetrakis(η⁵-cyclopentadienyl)-thorium(IV) and the temperature dependence of its electrical dipole momentMAIER, R; KANELLAKOPULOS, B; APOSTOLIDIS, C et al.Journal of alloys and compounds. 1993, Vol 190, Num 2, pp 269-271, issn 0925-8388Article

Structural parameter variations in chloroalkanesSTØLEVIK, R.Journal of molecular structure. 1993, Vol 291, Num 2-3, pp 301-312, issn 0022-2860Article

The molecular structures of divinyl sulfide and divinyl sulfoxide in the gas phase from electron diffractionROZSONDAI, B; HORVATH, Z. E.Perkin transactions. 2. 1993, Num 6, pp 1175-1180, issn 0300-9580Article

A molecular mechanics analysis of [Co (medien)₂ (dien)_2-n]³⁺ šn=0-2} (dien-diethylenetriamine or 1,5-diamino-3-azapentane ; medien=3-methyl-1,5-diamino-3-azapentane), and X-ray structural studies of the mer- and s-fac-[Co(medien) (dien)]²=3⁺ cationsATKINSON, I. M; KEENE, F. R; GULBIS, J. M et al.Journal of molecular structure. 1992, Vol 265, Num 1-2, pp 189-213, issn 0022-2860Article

Conformational studies by liquid crystal NMR and ab initio calculations : methyl nicotinate and methyl isonicotinateKON, M; KUROKAWA, H; TAKEUCHI, H et al.Journal of molecular structure. 1992, Vol 268, Num 1-3, pp 155-167, issn 0022-2860Article

Crystallographic and oxygen-17 NMR studies of nitro group torsion angles in a series of 4-aldylaminonitroquinolines designed as hypoxia-selective cytotoxinsBOYD, M; BOYD, P. D. W; ATWELL, G. J et al.Perkin transactions. 2. 1992, Num 4, pp 579-584, issn 0300-9580Article

Bond-stretch isomerism in the complexes cis-mer-MoOCl₂(PR₃)₃ : a reinvestigationYOON, K; PARKIN, G; RHEINGOLD, A. L et al.Journal of the American Chemical Society. 1992, Vol 114, Num 6, pp 2210-2218, issn 0002-7863Article

Conformational analysis of the anomeric forms of sophorose, laminarabiose, and cellobiose using MM3DOWD, M. K; FRENCH, A. D; REILLY, P. J et al.Carbohydrate research. 1992, Vol 233, pp 15-34, issn 0008-6215Article

Determination of the structure of CO₂-H₂COBLAKE, T. A; NOVICK, S. E; LOVAS, F. J et al.Journal of molecular spectroscopy (Print). 1992, Vol 154, Num 1, pp 72-82, issn 0022-2852Article

Molecular structure of 1,3,5-trifluorobenzene : comparison of the results of two electron diffraction studiesRAMONDO, F; PORTALONE, G; DOMENICANO, A et al.Journal of molecular structure. 1992, Vol 269, Num 3-4, pp 367-373, issn 0022-2860Article

Molecular structures and conformations of diethylamine and triethylamine as determined by gas electron diffraction, ab initio calculations, and vibrational spectroscopyTAKEUCHI, H; KOJIMA, T; EGAWA, T et al.Journal of physical chemistry (1952). 1992, Vol 96, Num 11, pp 4389-4396, issn 0022-3654Article

Molecular structures of titanium(IV) and vanadium(IV) amides and alkoxidesHAALAND, A; RYPDAL, K; VIDAR VOLDEN, H et al.Journal of the Chemical Society. Dalton transactions. 1992, Num 5, pp 891-895, issn 0300-9246Article

Raman spectroscopic study of cation capture of crown ethers having intramolecular strainFUKUSHIMA, K; NISHIYAMA, T; UNNO, Y et al.Journal of molecular structure. 1992, Vol 271, Num 4, pp 279-288, issn 0022-2860Article