Search results for "Benzene"
showing 10 items of 1701 documents
Residential Exposure to Outdoor Air Pollution during Pregnancy and Anthropometric Measures at Birth in a Multicenter Cohort in Spain
2011
Background: A growing body of research suggests that prenatal exposure to air pollution may be harmful to fetal development. We assessed the association between exposure to air pollution during pregnancy and anthropometric measures at birth in four areas within the Spanish Children’s Health and Environment (INMA) mother and child cohort study. Methods: Exposure to ambient nitrogen dioxide (NO2) and benzene was estimated for the residence of each woman (n = 2,337) for each trimester and for the entire pregnancy. Outcomes included birth weight, length, and head circumference. The association between residential outdoor air pollution exposure and birth outcomes was assessed with linear regress…
Supramolecular hierarchy among halogen and hydrogen bond donors in light-induced surface patterning
2015
Halogen bonding, a noncovalent interaction possessing several unique features compared to the more familiar hydrogen bonding, is emerging as a powerful tool in functional materials design. Herein, we unambiguously show that one of these characteristic features, namely high directionality, renders halogen bonding the interaction of choice when developing azobenzene-containing supramolecular polymers for light-induced surface patterning. The study is conducted by using an extensive library of azobenzene molecules that differ only in terms of the bond-donor unit. We introduce a new tetrafluorophenol-containing azobenzene photoswitch capable of forming strong hydrogen bonds, and show that an io…
Initiierte autoxydation von isotaktischem und ataktischem polybuten-1 in lösung
1968
Isotaktisches und ataktisches Polybuten-1 (PB) wurden bei 70,6°C in brombenzolischer Losung mit Azoisobuttersauredinitril als Initiator mit Sauerstoff oxydiert. Die oxydierten Proben wurden isoliert, und der Gehalt an Hydroperoxidgruppen wurde mit Hilfe von Triphenylphosphin bestimint. Cyclische Peroxide, die bei oxydiertem isotaktischem Polybuten 1 moglich sind, konnen nicht mit Triphenylphosphin bestimmt werden, da sie zerfallen, bevor sie mit dem Phosphin reagieren. Dies wurde an niedermolekularen Modellverbindungen uberpruft. Unter den Reaktionsbedingungen war die kinetische Kettenlange so klein (1 bis 2), das deutliche Unterschiede der Oxydation von isotaktischem und ataktischem Polybu…
5,11,17,23-Tetranitro-25,26,27,28-tetrapentyloxycalix[4]arene
2005
The molecule of the title compound, C48H60N4O12, is located on a crystallographic twofold rotation axis. It is found in the typical pinched cone conformation. The dihedral angles between the reference plane (defined by the C atoms of the methylene bridges) and the benzene rings are 83.33 (6) and 141.61 (5)°.
Molecular modeling and experimental studies on structure and NMR parameters of 9-benzyl-3,6-diiodo-9H-carbazole
2015
A combined experimental and theoretical study has been performed on 9-benzyl-3,6-diiodo-9H-carbazole. Experimental X-ray (100.0 K) and room-temperature 13C NMR studies were supported by advanced density functional theory (DFT) calculations. The non relativistic structure optimization was performed and the 13C nuclear magnetic shieldings were predicted at the relativistic level of theory using the Zeroth Order Regular Approximation (ZORA). The changes in the benzene and pyrrole rings compared to the unsubstituted carbazole or the parent molecules were discussed in terms of aromaticity changes using the harmonic oscillator model of aromaticity (HOMA) and the nucleus independent chemical shift…
Ethylbenzene removal under mesophilic conditions in a biofilter withMacadamia ternifolianutshells as a carrier material
2012
BACKGROUND Biofilters are suitable to treat industrial emissions polluted with volatile organic compounds (VOCs), responsible for photochemical smog and depletion of the ozone layer. This study analyzes the performance of a biofilter with Macadamia ternifolia nutshells as a carrier material treating air streams contaminated with ethylbenzene under mesophilic conditions with continuous feeding. RESULTS The biofilter was operated continuously for 5 months applying several inlet loads (IL), empty bed residence times (EBRT) and temperatures. At a temperature of 303 ± 1 K removal efficiencies (RE) higher than 90% were obtained for ILs lower than 85.6 g m−3 h−1 and 70.6 g m−3 h−1 at an EBRT of 15…
CCDC 291811: Experimental Crystal Structure Determination
2006
Related Article: F.A.Cotton, C.A.Murillo, S.-E.Stiriba, Xiaoping Wang, Rongmin Yu|2005|Inorg.Chem.|44|8223|doi:10.1021/ic051282c
CCDC 291816: Experimental Crystal Structure Determination
2006
Related Article: F.A.Cotton, C.A.Murillo, S.-E.Stiriba, Xiaoping Wang, Rongmin Yu|2005|Inorg.Chem.|44|8223|doi:10.1021/ic051282c
Free radical scavenging abilities of flavonoids as mechanism of protection against mutagenicity induced by tert-butyl hydroperoxide or cumene hydrope…
2003
Mutagenicity induced by tert-butyl hydroperoxide (BHP) or cumene hydroperoxide (CHP) in Salmonella typhimurium TA102 was effectively reduced by flavonols with 3',4'-hydroxyl groups such as fisetin, quercetin, rutin, isoquercitrin, hyperoxide, myricetin, myricitrin, robinetin, and to a lesser extent also by morin and kaempferol (ID50=0.25-1.05 micromol per plate). With the exception of isorhamnetin, rhamnetin, morin, and kaempferol, closely similar results were obtained with both peroxides. Hydrogenation of the double bond between carbons 2 and 3 (dihydroquercetin, dihydrorobinetin) as well as the additional elimination of the carbonyl function at carbon 4 (catechins) resulted in a loss of a…
X-ray and DFT-calculated structures of a vanadyl Schiff base complex: (methanol-κO)[2-methoxy-6-({2-[(2-oxido-3-methoxybenzylidene)amino]benzyl}imino…
2012
The central VVatom in the title mononuclear oxovanadium complex, [VO(C23H20N2O4)(CH3OH)]·H2O, has a distorted octahedral coordination. Two N atoms and two O atoms of the Schiff base define the base of the bipyramid and two O atoms are in the apical positions, one from vanadyl and the second from methanol. Density functional theory (DFT) calculations were performed for the title complex and its ligand to compare their geometry in the solid and gas phases. Additional analyses were made of the changes in the geometry of the ligand during complex formation. The HOMA (harmonic oscillator model of aromaticity) descriptor of π-electron delocalization was calculated to estimate the aromaticity of t…