93 research outputs found
Neutrinos
229 pages229 pages229 pagesThe Proceedings of the 2011 workshop on Fundamental Physics at the Intensity Frontier. Science opportunities at the intensity frontier are identified and described in the areas of heavy quarks, charged leptons, neutrinos, proton decay, new light weakly-coupled particles, and nucleons, nuclei, and atoms
Hydrogen-bonding in the structures of the hydrated proton-transfer compounds of isonipecotamide with the isomeric indole-2- and indole-3-carboxylic acids
The structures of two hydrated proton-transfer compounds of 4-piperidinecarboxamide (isonipecotamide) with the isomeric heteroaromatic carboxylic acids indole-2-carboxylic acid and indole-3-carboxylic acid, namely 4-carbamoylpiperidinium indole-2-carboxylate dihydrate (1) and 4-carbamoylpiperidinium indole-3-carboxylate hemihydrate (2) have been determined at 200 K. Crystals of both 1 and 2 are monoclinic, space groups P21/c and P2/c respectively with Z = 4 in cells having dimensions a = 10.6811(4), b = 12.2017(4), c = 12.5456(5) Å, β = 96.000(4)o (1) and a = 15.5140(4), b = 10.2908(3), c = 9.7047(3) Å, β = 97.060(3)o (2). Hydrogen-bonding in 1 involves a primary cyclic interaction involving complementary cation amide N-H…O(carboxyl) anion and anion hetero N-H…O(amide) cation hydrogen bonds [graph set R22(9)]. Secondary associations involving also the water molecules of solvation give a two-dimensional network structure which includes weak water O-H…π interactions. In the three-dimensional hydrogen-bonded structure of 2, there are classic centrosymmetric cyclic head-to-head hydrogen-bonded amide-amide interactions [graph set R22(8)] as well as lateral cyclic amide-O linked amide-amide extensions [graph set R24(8)]. The anions and the water molecule, which lies on a twofold rotation axis, are involved in secondary extensions
Structure of the antiplasmodial compound 7,9-dinitrocryptolepine hydrochloride methanol solvate.
noThe structure of C16H10N4O4[HCl,1.5CH3OH],
Mr = 406.80, has been determined from X-ray diffraction
data. The crystals are monoclinic, space group C2/c, with
eight molecules per unit cell and a = 21.482(4),
b = 7.131(1), c = 24.495(5) A ° , b = 111.01(3) , crystal
density Dc = 1.546 g/cm3. The material was difficult to
crystallize and crystals produced were found to be poor
diffractors. Intensity data were measured at liquid nitrogen
temperature using a weakly diffracting crystal typical of
the batch. However the X-ray analysis has finally enabled
the chemical constitution of this cryptolepine derivative,
which was previously incorrectly assigned, to be
unequivocally established. Direct methods were used to
solve the structure which was refined by full-matrix least
squares to a conventional R-index of 0.0798 for 2,861
reflections and 268 parameters. The 7,9-dinitrocryptolepine
molecule is highly planar with a strong intramolecular
hydrogen bond between N(10) in ring C and O(92) of a
nitro group. There are a number of intermolecular hydrogen
bonds involving the cryptolepine derivative the
hydrochloride and both solvated methanols. One of the
methanol solvate molecules (methanol 2) is unusually
disordered with its C atom lying exactly on a crystallographic
twofold axis. Consequently the methanol OH and
H3 groups are at 0.5 occupancy and repeated by the twofold
symmetry
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