Chemistry of the organic-rich hot core G327.3-0.6

We present gas-phase abundances of species found in the organic-rich hot core G327.3-0.6. The data were taken with the Swedish-ESO Submillimetre Telescope (SEST). The 1-3 mm spectrum of this source is dominated by emission features of nitrile species and saturated organics, with abundances greater than those found in many other hot cores, including Sgr B2 and OMC-1. Population diagram analysis indicates that many species (CH3CN, C2H3CN, C2H5CN, CH3OH, etc.) have hot components that originate in a compact (~2") region. Gas-phase chemical models cannot reproduce the high abundances of these molecules found in hot cores, and we suggest that they originate from processing and evaporation of icy grain mantle material. In addition, we report the first detection of vibrationally excited ethyl cyanide and the first detection of methyl mercaptan (CH3SH) outside the Galactic center.     

Mass spectrometric study of three-body ion-molecule clustering reactions of CpHq+ ions with N2 or CH4 in N2-CH4 mixtures

Thermochemical data for several ion-molecule clustering of hydrocarbon ions with N2 or CH4 were obtained from clustering equilibria studies in gas mixtures irradiated by alpha-particles. High-pressure mass spectrometry was used to determine the enthalpy and entropy changes of clustering (delta H0 and delta S0, respectively) for the reactions X+(N2)n-1 + 2N2 <==> X(+)(N2)n + N2 with X = CH5, n = 1-2; X = C2H5, n = 1-4; and X = C3H7, n = 1. For X = CH5, the values (delta H0; delta S0) are found to be (-6.8 kcal mol-1; -19.7 cal mol-1 K-1) for n = 1, and (-5.3 kcal mol-1; -15.9 cal mol-1 K-1) for n = 2. For X = C2H5, (delta H0; delta S0) = (-6.9 kcal mol-1; -18.2 cal mol-1 K-1), for n = 1, and (-4.6 kcal mol-1; -20.8 cal mol-1 K-1) for n = 2. From the equilibrium measurements at 129 K, estimates of the thermochemical values could be obtained for n = 3-4. The results obtained for the free energy, delta G0, were -1.4 kcal mol-1 for n = 3, and -1.1 kcal mol-1 for n = 4. For X = C3H7 we found delta G0 = -0.7 kcal mol-1 at 213 K. The association reactions X+ + 2CH4 <==> X+(CH4) + CH4 with X = CH5, C2H5, C2H7, and C3H7 were also studied, resulting in free energy values at 206 K of -3.1, -1.9, -0.5 and -1.3 kcal mol-1, respectively. The results for CH5, C2H5 and C3H7 are compared with previously reported measurements.     

Calculations concerning interstellar isomeric abundance ratios for C3H and C3H2

The syntheses of interstellar c-C3H2, H2CCC, c-C3H, and HCCC, where "c" stands for the cyclic isomer, are thought to proceed via dissociative recombination of the precursor ions c-C3H3+ and H2CCCH+, which are themselves produced mainly via the radiative association reaction between C3H+ and H2. We have utilized ab initio methods to study the potential energy surface (PES) for the association of the linear ion C3H+ and H2 to form the isomers c-C3H3+ and H2CCCH+. The overall rate coefficient for radiative association has been calculated as a function of temperature via the phase space method. Our ab initio calculations show that the H2CCCH+ isomer is formed directly without an activation barrier from reactants, and that isomerization between the two isomers can occur readily via a low-energy pathway consisting of two transition states (saddle points on the PES) and one intermediate (local minimum on the PES). Calculations of the equilibrium coefficient for the isomerization H2CCCH+ <-> c-C3H3+ as a function of energy shows that equal abundances of these two ions should be produced as relaxation proceeds, in agreement with experimental measurements at high pressure. Our results confirm the important point that a simple ion-molecule association reaction can produce a cyclic hydrocarbon. If dissociative recombination reactions involving c-C3H3+ and H2CCCH+ maintain the carbon skeletal structure of the ions and produce roughly similar C3H/C3H2 branching ratios, then abundance ratios of unity are produced between the cyclic and noncyclic isomers of C3H and C3H2 via this mechanism. The large abundance ratio of c-C3H2 to H2CCC observed in TMC-1 can then be explained by differential destruction rates.     

Multitransition study and new detections of class II methanol masers

We have used the ATNF Mopra antenna and the SEST antenna to search in the directions of several class II methanol maser sources for emission from six methanol transitions in the frequency range 85–115 GHz. The transitions were selected from excitation studies as potential maser candidates. Methanol emission at one or more frequencies was detected from five of the maser sources, as well as from Orion KL. Although the lines are weak, we find evidence of maser origin for three new lines in G345.01+1.79, and possibly one new line in G9.62+0.20.
The observations, together with published maser observations at other frequencies, are compared with methanol maser modelling for G345.01+1.79 and NGC 6334F. We find that the majority of observations in both sources are consistent with a warm dust (175 K) pumping model at hydrogen density ∼10⁶ cm⁻³ and methanol column density ∼ 5×10¹⁷ cm⁻². The substantial differences between the maser spectra in the two sources can be attributed to the geometry of the maser region.     

Detection of a new interstellar molecular ion, H2COH+ (protonated formaldehyde)

A new interstellar molecular ion, H2COH+ (protonated formaldehyde), has been detected toward Sgr B2, Orion KL, W51, and possibly in NGC 7538 and DR21(OH). Six transitions were detected in Sgr B2(M). The 1(1,0)-1(0,1) transition was detected in all sources listed above. Searches were also made toward the cold, dark clouds TMC-1 and L134N, Orion (3N, 1E), and a red giant, IRC + 10216, without success. The excitation temperatures of H2COH+ are calculated to be 60-110 K, and the column densities are on the order of 10(12)-10(14) cm-2 in Sgr B2, Orion KL, and W51. The fractional abundance of H2COH+ is on the order of 10(-11) to 10-(9), and the ratio of H2COH+ to H2CO is in the range 0.001-0.5 in these objects. The values in Orion KL seem to be consistent with the "early time" values of recent model calculations by Lee, Bettens, & Herbst, but they appear to be higher than the model values in Sgr B2 and W51 even if we take the large uncertainties of column densities of H2CO into account. We suggest production routes starting from CH3OH may play an important role in the formation of H2COH+.     

The detection of acetaldehyde in cold dust clouds

Observations of the 1(01) --> 0(00) rotational transitions of A and E state acetaldehyde are reported. The transitions were detected, for the first time in interstellar space, in the cold dust clouds TMC-1 and L134N, and in Sgr B2. This is also the first time acetaldehyde has been found in a dust cloud and is the most complex oxygen-bearing molecule yet known in this environment. We find a column density of 6 x 10(12) cm-2 in TMC-1, comparable to many other species detected there, and an approximately equal column density in L134N. In the direction of Sgr B2, the CH3CHO profile appears to consist of broad emission features from the hot molecular cloud core, together with absorption features resulting from intervening colder material. We also report the possible detection of HC9N toward IRC +10 degrees 216 through its J = 33 --> 32 transition. Implications for cold dust cloud chemistry and excitation are discussed.     

Ground-state OH observations towards NGC 6334

We have made observations of the four hyperfine transitions of the ²Π_3/2,     ground state of OH at 1612, 1665, 1667 and 1720 MHz and the related 1.6-GHz continuum emission towards NGC 6334 using the Australia Telescope Compact Array. The observations covered all the major radio continuum concentrations aligned along the axis of NGC 6334 (V, A to F). We have detected seven OH masers plus a possible faint eighth maser; two of these masers are located towards NGC 6334-A. Absorption at 1665 and 1667 MHz was detected towards almost all the continuum distribution. All transitions show non-LTE behaviour. The 1667-/1665-MHz intensity ratios range from 1.0 to 1.2, significantly less than their LTE value of 1.8. The results of the OH 'Sum Rule' suggest that this discrepancy cannot be explained solely by high optical depths. The 1612- and 1720-MHz line profiles show conjugate behaviour whereby one line is in absorption and the other in emission. In addition, the profiles commonly showed a flip from absorption to emission and vice versa, which is interpreted as a density gradient. The OH line-to-continuum distribution, optical depth and velocity trends are consistent with a bar-like shape for the molecular gas which wraps around the continuum emission.     

Measurements in N2-CH4(C2H2) discharges of reaction rates and thermochemical constants for Titan atmosphere study

The kinetic reactions in N2-xCH4(C2H2) gas discharges with x less than 1% have been studied by emission spectroscopy in the afterglow of D.C. discharges and by mass spectroscopy from radiolysis ionization using alpha particles. The pressure range is from several Torr to 100 Torr. At the end of N2 D.C. discharges at room temperature, for a residence time of about 10(-2) s, the dominant active species are the N atoms with density of 10(14)-10(15) cm-3 for N2 density of about 10(17) cm-3 (3 Torr), the N2(X,V) vibrational molecules with for example [N2(X,V = 10)] approximately 10(14) cm-3 and the electronic metastable molecules N2(A 3 sigma u +) with a density of 10(12) cm-3. In such conditions, the following kinetic reactions have been studied: N2(A) + N2(A) --> N2(C,B,V') + N2(X), N2(A) + N2(X,V>5) --> N2(X) + N2(B,V') in pure N2 post-discharges and N2(A) + CH4 --> products, C + N + M2 --> CN(B,V') + M2, N2(X,V>4) + CN --> N2(X) + CN(B,A,V'), in N2-1% CH4 post-discharges. The clustering reactions of N2-(1-5%)CH4(C2H2) gas mixtures after radiolysis ionization have been studied for the H2CN+ nN2 ions and the equilibrium constants have been determined in the temperature range T = 140-300 K.     

Detection of interstellar ethylene oxide (c-C2H4O)

We report the identification of 10 transitions that support the detection of the small cyclic molecule ethylene oxide (c-C2H4O) in Sgr B2N. Although one of these transitions is severely blended, so that an accurate intensity and line width could not be determined, and two other lines are only marginally detected, we have done Gaussian fits to the remaining seven lines and have performed a rotation diagram analysis. Our results indicate a rotation temperature T(rot) = 18 K and a molecular column density N(c-C2H4O) = 3.3 x 10(14) cm-2, corresponding to a fractional abundance relative to molecular hydrogen of order 6 x 10(-11). This is a factor of more than 200 higher than the abundance for this molecule suggested by the "new standard" chemistry model of Lee, Bettens, & Herbst. This result suggests that grain chemistry might play an effective role in the production of c-C2H4O. No transitions of this molecule were detected in either Sgr B2M or Sgr B2NW.     

Near-infrared imaging in H2 of molecular (CO) outflows from young stars

We have imaged several known molecular (CO) outflows in H₂ v=1-0 S(1) and wide-band K in order to identify the molecular shocks associated with the acceleration of ambient gas by outflows from young stars. We detected H₂ line emission in all the flows we observed: L 1157, VLA 1623, NGC 6334I, NGC 2264G, L 1641N and Haro 4-255. A comparison of the H₂ data with CO outflow maps strongly suggests that prompt entrainment near the head of a collimated jet probably is the dominant mechanism for producing the CO outflows in these sources.     

Carbon Dioxide in Star-forming Regions

Observations with the Short Wavelength Spectrometer on board the Infrared Space Observatory have led to the first detection of the methyl radical CH(3) in the interstellar medium. The nu(2) Q-branch at 16.5 μm and the R(0) line at 16.0 μm have been unambiguously detected toward the Galactic center Sagittarius A*. The analysis of the measured bands gives a column density of &parl0;8.0+/-2.4&parr0;x1014 cm(-2) and an excitation temperature of 17+/-2 K. Gaseous CO at a similarly low excitation temperature and C(2)H(2) are detected for the same line of sight. Using constraints on the H(2) column density obtained from C(18)O and visual extinction, the inferred CH(3) abundance is &parl0;1.3+2.2-0.7&parr0;x10-8. The chemically related CH(4) molecule is not detected, but the pure rotational lines of CH are seen with the Long Wavelength Spectrometer. The absolute abundances and the CH(3)/CH(4) and CH(3)/CH ratios are inconsistent with published pure gas-phase models of dense clouds. The data require a mix of diffuse and translucent clouds with different densities and extinctions, and/or the development of translucent models in which gas-grain chemistry, freeze-out, and reactions of H with polycyclic aromatic hydrocarbons and solid aliphatic material are included.     

Astrophysical properties of red giants in three open clusters older than the hyades

Results fromCMT ₁T₂ 1T2 broad-band and DDO intermediate-band photometry are presented for G and K giants in the old open clusters NGC. 2482, NGC 3680, and IC 4651. Two independent photometric criteria have been used to separate red field stars from the physical members of the clusters. Recent calibrations of the DDO andCMT ₁T₂ systems have been used to derive reddening, distance moduli, metallicities, effective temperatures, and surface gravities. Rough estimates of masses have also been made. The giants of NGC 2482 and IC 4651 have CN strengths nearly identical to the Hyades giants, while those of NGC 3680 are slightly richer in CN than the nearby K giants.CMT1T2 abundance analysis in NGC 2482 and NGC 3680 yield [Fe/H]_MT = - 0.1 ± 0.1 as derived from the iron lines, while abundances derived from the CNO - contaminated (C - M) index are 0.4 dex higher. BothCMT ₁T₂ and DDO data support the conclusion that 1C 4651, with [Fe/H] = + 0.2 ± 0.1, is on the metalrich side of the distribution of intermediate and old open clusters. Finally, the mass results suggest that the clump stars in NGC 3680 and. IC 4651 could have undergone mass loss before reaching their helium core burning phase of evolution. Supported in part by the Consejo Nacional de Investigaciones Cientificas y Tecnicas (CONICET) of Argentina. Visiting astronomer of Cerro Tololo Inter-American Observatory supported by the National Science Foundation under contract No. AST 74-04128.     

Radiation chemistry in the Jovian stratosphere: laboratory simulations

Low-pressure continuous-flow laboratory simulations of plasma induced chemistry in H2/He/CH4/NH3 atmospheres show radiation yields of hydrocarbons and nitrogen-containing organic compounds that increase with decreasing pressure in the range 2-200 mbar. Major products of these experiments that have been observed in the Jovian atmosphere are acetylene (C2H2), ethylene (C2H4), ethane (C2H6), hydrogen cyanide (HCN), propane (C3H8), and propyne (C3H4). Major products that have not yet been observed on Jupiter include acetonitrile (CH3CN), methylamine (CH3NH2), propene (C3H6), butane (C4H10), and butene (C4H8). Various other saturated and unsaturated hydrocarbons, as well as other amines and nitriles, are present in these experiments as minor products. We place upper limits of 10(6)-10(9) molecules cm-2 sec-1 on production rates of the major species from auroral chemistry in the Jovian stratosphere, and calculate stratospheric mole fraction contributions. This work shows that auroral processes may account for 10-100% of the total abundances of most observed organic species in the polar regions. Our experiments are consistent with models of Jovian polar stratospheric aerosol haze formation from polymerization of acetylene by secondary ultraviolet processing.     

HCO emission from H II-molecular cloud interface regions

A survey of well-known molecular clouds in the four strongest HCO NK-,K+ = 1(01)-0(00) hyperfine transitions has been carried out to determine the prevalence of HCO and to study its chemistry. HCO emission was observed in seven molecular clouds. Three of these, NGC 2264, W49, and NGC 7538, were not previously known sources of HCO. In addition, NGC 2024 and Sgr B2 were mapped and shown to have extensive HCO emission. The survey results show the HCO abundance to be enhanced in H II-molecular cloud interface regions and support a correlation between C+ and HCO emission. The strength of the HCO emission in NGC 2024 is interpreted in terms of this enhancement and the source structure and proximity to Earth.     

Star formation in NGC 6334 I and I(N)

The northern section of the molecular cloud complex NGC 6334 has been mapped in the CO and CS spectral line emission and in continuum emission at a wavelength of 1300 μm. Our observations highlight the two dominant sources, I and I(N), and a host of weaker sources. NGC 6334 I is associated with a cometary ultracompact H  ii region and a hot, compact core ≤10 arcsec in size. Mid-infrared and CH₃OH observations indicate that it is also associated with at least two protostellar sources, each of which may drive a molecular outflow. For region I we confirm the extreme high-velocity outflow first discovered by Bachiller & Cernicharo and find that it is very energetic with a mechanical luminosity of 390 L_⊙. A dynamical age for the outflow is ∼3000 yr. We also find a weaker outflow originating from the vicinity of NGC 6334 I. In CO and CS this outflow is quite prominent to the north-west, but much less so on the eastern side of I, where there is very little molecular gas. Spectral survey data show a molecular environment at position I which is rich in methanol, methyl formate and dimethyl ether, with lines ranging in energy up to 900 K above the ground state. NGC 6334 I(N) is more dense than I, but cooler, and has none of the high-excitation lines observed toward I. I(N) also has an associated outflow, but it is less energetic than the outflow from I. The fully sampled continuum map shows a network of filaments, voids and cores, many of which are likely to be sites of star formation. A striking feature is a narrow, linear ridge which defines the western boundary. It is unclear if there is a connection between this filament and the many potential sites of star formation, or if the filament existed prior to the star formation activity.     

The thermal and non-thermal components of sixteen nebular complexes

The nature of the fine structure of sixteen galactic nebular complexes is investigated by producing their radio spectra. The complexes are: W31, W33, W35, K39, W42, W40, W43, W48, W47, W49, K47, W51, W3, Carina, NGC 6334 and NGC 6357. Various physical parameters of the thermal components are derived by adopting a homogeneous, optically thin, spherical model. The variations of the physical parameters derived from the model as a function of the electron temperature and distance are investigated. A discussion about the thermal and non-thermal spectra is included. Some simple statistics on the physical parameters of the thermal sources (diameter, density, mass) are also presented by employing a sample of sixty-seven thermal components.     

Interstellar cyanomethane

We have made an observational study of the newly identified cyanomethane radical CH2CN and the possibly related species CH3CN with the goals of (1) elucidating the possible role of reactions of the type CnHm(+) + N in astrochemistry, and (2) providing a possible test of Bates's models of dissociative electron recombination. We find a remarkably different abundance ratio CH2CN/CH3CN in TMC-1 and Sgr B2, which we deduce is a result of the large difference in temperature of these objects. Studies of CH2CN and CH3CN in other sources, including two new detections of CH2CN, support this conclusion and are consistent with a monotonic increase in the CH2CN/CH3CN ratio with decreasing temperature over the range 10-120 K. This behavior may be explained by the destruction of CH2CN by reaction with O. If this reaction does not proceed, then CH2CN and CH3CN are concluded to form via different chemical pathways. Thus, they do not provide a test of Bates's conjectures (they do not both form from CH3CNH+). CH2CN is then likely to form via C2H4(+) + N --> CH2CNH+, thus demonstrating the viability of this important reaction in astrochemistry. The T dependence of the CH2CN/CH3CN ratio would then reflect the increasing rate of the C2H4(+) + N reaction with decreasing temperature.     

Physical parameters of the diffuse molecular cloud envelope at G180.9+4.1, next to S241

Methylidyne (CH) line observations were obtained at Algonquin from the diffuse molecular cloud envelope at G180.9+4.1, sandwiched between the optical H II region S241 and the molecular cloud core at G180.8+4.0. An analysis of these observations yields several of the envelope parameters, notably a CH column density of 2×10¹³ cm^–2, a microturbulent velocity of 2.6 km s^–1, and a total space density of 40 cm^–3.     

Gas-phase models for the evolved planetary nebulae NGC 6781, M4-9 and NGC 7293

We have studied the chemistry of the molecular gas in evolved planetary nebulae. Three pseudo-time-dependent gas-phase models have been constructed for dense (10⁴–10⁵ cm⁻³) and cool ( T ∼15 K) clumpy envelopes of the evolved nebulae NGC 6781, M4-9 and NGC 7293. The three nebulae are modelled as carbon-rich stars evolved from the asymptotic giant branch to the late planetary nebula phase. The clumpy neutral envelopes are subjected to ultraviolet radiation from the central star and X-rays that enhance the rate of ionization in the clumps. With the ionization rate enhanced by four orders of magnitude over that of the ISM, we find that resultant abundances of the species HCN, HNC, HC₃N and SiC₂ are in good agreement with observations, while those of CN, HCO⁺, CS and SiO are in rough agreement. The results indicate that molecular species such as CH, CH₂, CH₂⁺ , HCl, OH and H₂O are anticipated to be highly abundant in these objects.     

Observations of some oxygen-containing and sulfur-containing organic molecules in cold dark clouds

Observations of nine oxygen- and sulfur-containing organic molecules have been made toward the cold dark clouds TMC-1 and L134N. We have confirmed the presence of para-ketene (H2C2O) in TMC-1, have for the first time observed ortho-ketene, and find a total ketene column density approximately 1 x 10(13) cm-2. Thioformaldehyde (H2CS) is easily detectable in both TMC-1 and L134N, with a column density about 5 times larger in the former source (approximately 3 x 10(13) cm-2). The fractional abundance of ketene is comparable to the predictions of ion-molecule chemistry, while that of thioformaldehyde in TMC-1 is one to two orders of magnitude greater than that expected from such models at steady state. Interstellar sulfur chemistry thus continues to be poorly understood. We set upper limits for the column densities of formic acid (HCOOH), vinyl alcohol (CH2CHOH), methyl formate (HCO2CH3), formamide (NH2CHO), methyl mercaptan (CH3SH), isothiocyanic acid (HNCS), and thioketene (H2C2S) in both sources.