Semiempirical calculation of barriers to pyramidal inversion for first- and second-row elements

Arvi Rauk; Joseph D. Andose; Willis G. Frick; Reginald Tang; Kurt Mislow

doi:10.1021/ja00753a029

Semiempirical calculation of barriers to pyramidal inversion for first- and second-row elements

Journal of the American Chemical Society ◽

10.1021/ja00753a029 ◽

1971 ◽

Vol 93 (24) ◽

pp. 6507-6515 ◽

Cited By ~ 94

Author(s):

Arvi Rauk ◽

Joseph D. Andose ◽

Willis G. Frick ◽

Reginald Tang ◽

Kurt Mislow

Keyword(s):

Semiempirical Calculation ◽

Pyramidal Inversion

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Semiempirical calculation of barriers to pyramidal inversion. Extension to the third row of the periodic table

Journal of the American Chemical Society ◽

10.1021/ja00829a016 ◽

1974 ◽

Vol 96 (22) ◽

pp. 6904-6907 ◽

Cited By ~ 35

Author(s):

Joseph D. Andose ◽

Arvi Rauk ◽

Kurt Mislow

Keyword(s):

Periodic Table ◽

Semiempirical Calculation ◽

The Third ◽

Pyramidal Inversion

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ChemInform Abstract: SEMIEMPIRICAL CALCULATION OF BARRIERS TO PYRAMIDAL INVERSION. EXTENSION TO THE THIRD ROW OF THE PERIODIC TABLE

Chemischer Informationsdienst ◽

10.1002/chin.197502357 ◽

1975 ◽

Vol 6 (2) ◽

Author(s):

JOSEPH D. ANDOSE ◽

ARVI RAUK ◽

KURT MISLOW

Keyword(s):

Periodic Table ◽

Semiempirical Calculation ◽

The Third ◽

Pyramidal Inversion

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Semiempirical calculation of optical rotatory strength of non-planar conformations of formamide

Collection of Czechoslovak Chemical Communications ◽

10.1135/cccc19780781 ◽

1978 ◽

Vol 43 (3) ◽

pp. 781-790 ◽

Cited By ~ 13

Author(s):

Petr Maloň ◽

Slavomír Bystrický ◽

Karel Bláha

Keyword(s):

Semiempirical Calculation ◽

Optical Rotatory ◽

Optical Rotatory Strength

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ChemInform Abstract: Lipase Catalyzed Resolution of α-Hydroxymethyl Sulfones. Determination of Absolute Configuration by Semiempirical Calculation of CD Spectra and Verification by X-Ray Structure Analysis.

ChemInform ◽

10.1002/chin.199806056 ◽

2010 ◽

Vol 29 (6) ◽

pp. no-no

Author(s):

H.-J. GAIS ◽

I. VON DER WEIDEN ◽

J. FLEISCHBAUER ◽

J. ESSER ◽

G. RAABE

Keyword(s):

Structure Analysis ◽

Absolute Configuration ◽

Semiempirical Calculation ◽

Cd Spectra ◽

X Ray ◽

Determination Of Absolute Configuration

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ChemInform Abstract: CONFORMATIONAL ANALYSIS OF THE THIOLANE RING SYSTEM PART 1, STEREOCHEMISTRY OF THE BASE-CATALYZED H-D EXCHANGE, PYRAMIDAL INVERSION, AND PROTON MAGNETIC RESONANCE STECTRUM OF TRANS-3-METHYL-3-THIONIABICYCLO(4.3.0)NONANE JODIDE, A CONF

Chemischer Informationsdienst ◽

10.1002/chin.197406074 ◽

1974 ◽

Vol 5 (6) ◽

Author(s):

G. BARBARELLA ◽

A. GARBESI ◽

A. BOICELLI ◽

A. FAVA

Keyword(s):

Magnetic Resonance ◽

Conformational Analysis ◽

Proton Magnetic Resonance ◽

Ring System ◽

Pyramidal Inversion ◽

System Part

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Semiempirical calculation of ESCA shifts in oxygen, nitrogen, fluorine and silicon inner core levels by the AM1-AMEP model

Journal of Molecular Structure ◽

10.1016/0022-2860(91)87080-2 ◽

1991 ◽

Vol 247 ◽

pp. 305-312 ◽

Cited By ~ 5

Author(s):

Z.B. Maksić ◽

D. Kovaček ◽

T. Šuste

Keyword(s):

Inner Core ◽

Semiempirical Calculation

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Pyramidal inversion in arsindoles. Evidence for cyclic (4p-2p) .pi. conjugation

Journal of the American Chemical Society ◽

10.1021/ja00763a055 ◽

1972 ◽

Vol 94 (8) ◽

pp. 2861-2862 ◽

Cited By ~ 24

Author(s):

Reid H. Bowman ◽

Kurt Mislow

Keyword(s):

Pyramidal Inversion ◽

Pi Conjugation

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Semiempirical calculation of silver clusters with chemisorbed oxygen

Theoretical and Experimental Chemistry ◽

10.1007/bf00530602 ◽

1994 ◽

Vol 29 (2) ◽

pp. 91-94

Author(s):

V. S. Gurin ◽

A. B. Kovrikov

Keyword(s):

Semiempirical Calculation ◽

Silver Clusters ◽

Chemisorbed Oxygen

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Metal-Assisted Pyramidal Inversion in Metal-Phosphido Complexes

Inorganic Chemistry ◽

10.1021/ic00092a015 ◽

1994 ◽

Vol 33 (14) ◽

pp. 3104-3110 ◽

Cited By ~ 26

Author(s):

Jimmy R. Rogers ◽

Timothy P. S. Wagner ◽

Dennis S. Marynick

Keyword(s):

Pyramidal Inversion

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Nuclear magnetic resonance investigations of configurational non-rigidity in dinuclear platinum(IV) complexes. Part 6. Synchronous pyramidal inversion of chalcogen atoms in [(PtXMe3)2(ECH2CME2CH2E)] complexes (E = S or Se; X = Cl, Br, or I)

Journal of the Chemical Society Dalton Transactions ◽

10.1039/dt9860000961 ◽

1986 ◽

pp. 961-966 ◽

Cited By ~ 9

Author(s):

Edward W. Abel ◽

Pramod K. Mittal ◽

Keith G. Orrell ◽

Vladimir Šik

Keyword(s):

Nuclear Magnetic Resonance ◽

Magnetic Resonance ◽

Pyramidal Inversion ◽

Dinuclear Platinum ◽

Nuclear Magnetic

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