氟甲烷-13C
氟甲烷-13C结构式
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常用名 | 氟甲烷-13C | 英文名 | fluoromethane-13c |
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| CAS号 | 20666-44-8 | 分子量 | 35.02560 | |
| 密度 | 1.231 (vs air) | 沸点 | -77.9ºC(lit.) | |
| 分子式 | CH3F | 熔点 | -141.8ºC(lit.) | |
| MSDS | 中文版 美版 | 闪点 | N/A | |
| 符号 |
GHS02, GHS04 |
信号词 | Danger |
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Theoretical studies on identity S(N)2 reactions of lithium halide and methyl halide: a microhydration model.
J. Mol. Model. 16(12) , 1931-7, (2010) Reactions of lithium halide (LiX, X = F, Cl, Br and I) and methyl halide (CH₃X, X = F, Cl, Br and I) have been investigated at the B3LYP/6-31G(d) level of theory using the microhydration model. Beginning with hydrated lithium ion, four or two water molecules ... |
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A-band methyl halide dissociation via electronic curve crossing as studied by electron energy loss spectroscopy.
J. Chem. Phys. 133(5) , 054304, (2010) Excitation of the A-band low-lying electronic states in the methyl halides, CH(3)I, CH(3)Br, CH(3)Cl, and CH(3)F, has been investigated for the (n-->sigma*) transitions, using electron energy loss spectroscopy (EELS) in the range of 3.5-7.5 eV. For the methyl... |
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Near-thermal reactions of Au(+)(1S,3D) with CH3X (X = F,Cl).
J. Phys. Chem. A 116(3) , 943-51, (2012) Reactions of Au(+)((1)S) and Au(+)((3)D) with CH(3)F and CH(3)Cl have been carried out in a drift cell in He at a pressure of 3.5 Torr at both room temperature and reduced temperatures in order to explore the influence of the electronic state of the metal on ... |
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Electrophilic trifluoromethanesulfanylation of organometallic species with trifluoromethanesulfanamides.
Angew. Chem. Int. Ed. Engl. 51(41) , 10382-5, (2012)
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Does fluoromethane form a hydrogen bond with water?
J. Phys. Chem. A 116(44) , 10842-9, (2012) Fluorinated organic compounds have become increasingly important in the pharmaceutical and agricultural industries. However, even the simplest aspects of these compounds are still not well understood. For instance, it is an open question as to whether fluoroo... |
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Structure, vibrational spectra, and unimolecular dissociation of gaseous 1-fluoro-1-phenethyl cations.
J. Phys. Chem. A 112(43) , 10774-83, (2008) The multiple CF bond character of PhCFMe (+) ions has been examined by means of theory, vibrational spectroscopy of the gaseous ions, and unimolecular decomposition chemistry. Atoms in Molecules analysis of DFT wave functions gives a CF bond order of n = 1.25... |
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Enaminones 12. An explanation of anticonvulsant activity and toxicity per Linus Pauling's clathrate hypothesis.
Eur. J. Med. Chem. 51 , 42-51, (2012) The x-ray crystal structure of 3-((5-methylisoxazol-3-yl)amino)-5-methylcyclohex-2-enone (12b) and 3-((5-methylisoxazolyl-3-yl)amino)-5,5-dimethylcyclohex-2-enone (12c) were determined and correlated to their anticonvulsant activity in mice and rats. A hypoth... |
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Quantification of the inhibitory effect of methyl fluoride on methanogenesis in mesophilic anaerobic granular systems.
Chemosphere 84(9) , 1194-9, (2011) The inhibitory effect of CH(3)F on methanogenesis in mesophilic anaerobic granules was tested at different concentrations (0-10% v/v, in the gas phase) and verified by the stable carbon isotopic signatures of CH(4) and CO(2). The results showed that the inhib... |
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Methyl fluoride affects methanogenesis rather than community composition of methanogenic archaea in a rice field soil.
PLoS ONE 8(1) , e53656, (2013) The metabolic pathways of methane formation vary with environmental conditions, but whether this can also be linked to changes in the active archaeal community structure remains uncertain. Here, we show that the suppression of aceticlastic methanogenesis by m... |
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Study of the interaction in clusters formed by phenol and CH3X (X=CN,F,Cl) molecules.
J. Chem. Phys. 128(19) , 194311, (2008) The characteristics of the interaction between phenol and acetonitrile, methyl fluoride and methyl chloride were studied. The most stable structures for clusters containing one or two CH3X molecules and one phenol moiety were located by means of ab initio and... |