Comparative structural studies of [3.1.0]-fused 2',3'-modified .beta.-D-nucleosides by x-ray crystallography, NMR spectroscopy, and molecular mechanics calculations

Leo H. Koole; Stephen Neidle; Mark D. Crawford; Alexander A. Krayevski; Galyna V. Gurskaya; Anders Sandstroem; Jin Chang Wu; Weimin Tong; Jyoti Chattopadhyaya

doi:10.1021/jo00024a034

Comparative structural studies of [3.1.0]-fused 2',3'-modified .beta.-D-nucleosides by x-ray crystallography, NMR spectroscopy, and molecular mechanics calculations

The Journal of Organic Chemistry ◽

10.1021/jo00024a034 ◽

1991 ◽

Vol 56 (24) ◽

pp. 6884-6892 ◽

Cited By ~ 19

Author(s):

Leo H. Koole ◽

Stephen Neidle ◽

Mark D. Crawford ◽

Alexander A. Krayevski ◽

Galyna V. Gurskaya ◽

...

Keyword(s):

Nmr Spectroscopy ◽

Molecular Mechanics ◽

Structural Studies ◽

Molecular Mechanics Calculations ◽

X Ray ◽

X Ray Crystallography

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ChemInform Abstract: Conformational Study of N-Nitroso-2,6-diphenylpiperidines and N- Nitroso-2,6-diphenylpiperidin-4-ones by Molecular Mechanics Calculations, X-Ray Crystallography, and 1H and 13C NMR Spectroscopy.

ChemInform ◽

10.1002/chin.199614042 ◽

2010 ◽

Vol 27 (14) ◽

pp. no-no

Author(s):

M. GDANIEC ◽

M. J. MILEWSKA ◽

T. POLONSKI

Keyword(s):

Nmr Spectroscopy ◽

Molecular Mechanics ◽

13C Nmr ◽

13C Nmr Spectroscopy ◽

Conformational Study ◽

Molecular Mechanics Calculations ◽

1H And 13C Nmr ◽

X Ray ◽

X Ray Crystallography

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Synthesis of new N2S2 ligands and Re(V)O(N2S2) analogues of 99mTc renal imaging agents. Characterization by NMR spectroscopy, molecular mechanics calculations, and X-ray crystallography

Inorganica Chimica Acta ◽

10.1016/s0020-1693(02)00960-x ◽

2002 ◽

Vol 339 ◽

pp. 327-340 ◽

Cited By ~ 19

Author(s):

Malgorzata Lipowska ◽

Lory Hansen ◽

Renzo Cini ◽

Xiaolong Xu ◽

Hoon Choi ◽

...

Keyword(s):

Nmr Spectroscopy ◽

Molecular Mechanics ◽

Imaging Agents ◽

Molecular Mechanics Calculations ◽

Renal Imaging ◽

X Ray ◽

X Ray Crystallography

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Chiral polyhydroxylated tetrahydrothiophene derivatives: novel synthesis and structural elucidation by X-ray crystallography, NMR spectroscopy and molecular mechanics calculations

Journal of the Chemical Society Perkin Transactions 1 ◽

10.1039/p19930001255 ◽

1993 ◽

pp. 1255 ◽

Cited By ~ 5

Author(s):

A. V. Rama Rao ◽

K. Ashok Reddy ◽

N. R. Srinivas ◽

M. K. Gurjar ◽

N. Padmaja ◽

...

Keyword(s):

Nmr Spectroscopy ◽

Molecular Mechanics ◽

Structural Elucidation ◽

Molecular Mechanics Calculations ◽

X Ray ◽

X Ray Crystallography ◽

Novel Synthesis

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ChemInform Abstract: Chiral Polyhydroxylated Tetrahydrothiophene Derivatives: Novel Synthesis and Structural Elucidation by X-Ray Crystallography, NMR Spectroscopy and Molecular Mechanics Calculations.

ChemInform ◽

10.1002/chin.199340182 ◽

2010 ◽

Vol 24 (40) ◽

pp. no-no

Author(s):

A. V. R. RAO ◽

K. A. REDDY ◽

N. R. SRINIVAS ◽

M. K. GURJAR ◽

N. PADMAJA ◽

...

Keyword(s):

Nmr Spectroscopy ◽

Molecular Mechanics ◽

Structural Elucidation ◽

Molecular Mechanics Calculations ◽

X Ray ◽

X Ray Crystallography ◽

Novel Synthesis

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Conformational Study of N-Nitroso-2,6-diphenylpiperidines and N-Nitroso-2,6-diphenylpiperidin-4-ones by Molecular Mechanics Calculations, X-ray Crystallography, and 1H and 13C NMR Spectroscopy

The Journal of Organic Chemistry ◽

10.1021/jo00128a011 ◽

1995 ◽

Vol 60 (23) ◽

pp. 7411-7418 ◽

Cited By ~ 39

Author(s):

Maria Gdaniec ◽

Maria J. Milewska ◽

Tadeusz Po-lonski

Keyword(s):

Nmr Spectroscopy ◽

Molecular Mechanics ◽

13C Nmr ◽

13C Nmr Spectroscopy ◽

Conformational Study ◽

Molecular Mechanics Calculations ◽

1H And 13C Nmr ◽

X Ray ◽

X Ray Crystallography

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Molecular structure of [4-(4-cyanobenzoyl) phenyl] 1,5-dithio-β-d-xylopyranoside (naroparcil) in the solid state and in solution: An investigation by X-ray crystallography, molecular mechanics calculations, and NMR spectroscopy

Carbohydrate Research ◽

10.1016/0008-6215(96)00013-4 ◽

1996 ◽

Vol 284 (1) ◽

pp. 35-49 ◽

Cited By ~ 2

Author(s):

Jean-Yves Le Questel ◽

Nadine Mouhous-Riou ◽

Serge Pérez

Keyword(s):

Molecular Structure ◽

Solid State ◽

Nmr Spectroscopy ◽

Molecular Mechanics ◽

Molecular Mechanics Calculations ◽

X Ray ◽

X Ray Crystallography

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ChemInform Abstract: Conformational Analysis of 2-Aminotetralins: Molecular Mechanics Calculations, X-Ray Crystallography and NMR Spectroscopy.

ChemInform ◽

10.1002/chin.199410035 ◽

2010 ◽

Vol 25 (10) ◽

pp. no-no

Author(s):

A. KARLEN ◽

A. HELANDER ◽

A. M. JOHANSSON ◽

L. KENNE ◽

S. SUNDELL ◽

...

Keyword(s):

Nmr Spectroscopy ◽

Conformational Analysis ◽

Molecular Mechanics ◽

Molecular Mechanics Calculations ◽

X Ray ◽

X Ray Crystallography

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Structural analysis of methyl α-l-fucopyranoside by X-ray crystallography, NMR spectroscopy, and molecular mechanics calculations

Carbohydrate Research ◽

10.1016/0008-6215(93)87030-v ◽

1993 ◽

Vol 243 (2) ◽

pp. 217-224 ◽

Cited By ~ 13

Author(s):

D. Lamba ◽

A.L. Segre ◽

G. Fabrizi ◽

B. Matsuhiro

Keyword(s):

Nmr Spectroscopy ◽

Structural Analysis ◽

Molecular Mechanics ◽

Molecular Mechanics Calculations ◽

X Ray ◽

X Ray Crystallography

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Structures of norbornane and dodecahedrane by molecular mechanics calculations (MM3), x-ray crystallography, and electron diffraction

Journal of the American Chemical Society ◽

10.1021/ja00185a048 ◽

1989 ◽

Vol 111 (3) ◽

pp. 1106-1114 ◽

Cited By ~ 60

Author(s):

N. L. Allinger ◽

H. J. Geise ◽

W. Pyckhout ◽

L. A. Paquette ◽

J. C. Gallucci

Keyword(s):

Electron Diffraction ◽

Molecular Mechanics ◽

Molecular Mechanics Calculations ◽

X Ray ◽

X Ray Crystallography

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Synthesis and structural studies of 4-[(5-methoxy-1H-indole-3-yl)-methylene]-3-methyl-isoxazole-5-one by X-ray crystallography, NMR spectroscopy, and DFT calculations

Journal of Molecular Structure ◽

10.1016/j.molstruc.2011.03.052 ◽

2011 ◽

Vol 994 (1-3) ◽

pp. 371-378 ◽

Cited By ~ 11

Author(s):

X.H. Zhang ◽

L.Y. Wang ◽

Y.H. Zhan ◽

Y.L. Fu ◽

G.H. Zhai ◽

...

Keyword(s):

Nmr Spectroscopy ◽

Dft Calculations ◽

Structural Studies ◽

X Ray ◽

X Ray Crystallography

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