Negative hyperconjugation and red-, blue- or zero-shift in X-Z∙∙∙Y complexes.

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The intrinsic strength of the halogen bond: electrostatic and covalent contributions described by coupled cluster theory.Stereoelectronic Chameleons: The Donor-Acceptor Dichotomy of Functional Groups.Continuum in the X-Z---Y weak bonds: Z= main group elements.

P2860

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P2860

Negative hyperconjugation and red-, blue- or zero-shift in X-Z∙∙∙Y complexes.

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2015 nî lūn-bûn

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2015年の論文

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2015年論文

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2015年論文

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2015年論文

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2015年論文

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2015年論文

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2015年论文

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2015年论文

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2015年论文

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name

Negative hyperconjugation and red-, blue- or zero-shift in X-Z∙∙∙Y complexes.

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type

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Negative hyperconjugation and red-, blue- or zero-shift in X-Z∙∙∙Y complexes.

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prefLabel

Negative hyperconjugation and red-, blue- or zero-shift in X-Z∙∙∙Y complexes.

@en

P1476

Negative hyperconjugation and red-, blue- or zero-shift in X-Z∙∙∙Y complexes

@en

P2093

Kaipanchery Vidya

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P2860

The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errors

What is the covalency of hydrogen bonding?

A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu.

NBO 6.0: natural bond orbital analysis program.

The nature of improper, blue-shifting hydrogen bonding verified experimentally.

Nature of halogen bonding. A study based on the topological analysis of the Laplacian of the electron charge density and an energy decomposition analysis.

Halogen bonding and other σ-hole interactions: a perspective.

Hybridization trends for main group elements and expanding the Bent's rule beyond carbon: more than electronegativity.

Theoretical investigations on chalcogen-chalcogen interactions: what makes these nonbonded interactions bonding?

Tetrel bond-σ-hole bond as a preliminary stage of the SN2 reaction.

P304

33-50

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scholarly article

P356

10.1039/C4FD00183D

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P478

177

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Eluvathingal Jemmis

Jyothish Joy

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2015-01-01T00:00:00Z

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272081157

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25653178

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Negative hyperconjugation and red-, blue- or zero-shift in X-Z∙∙∙Y complexes.

about

P2860

P2860

Negative hyperconjugation and red-, blue- or zero-shift in X-Z∙∙∙Y complexes.

description

name

type

label

prefLabel

P1433

P1476

P2093

P2860

P304

P31

P356

P478

P50

P577

P5875

P698

P356

P1433

P1476

P2093

P2860

P304

P31

P356

P478

P50

P577

P5875

P698