Spectroscopic investigation of the à A1 ″ - X̃XXXX′ a1 electronic transition of HSiNCO

Journal of Chemical Physics

Volumn 131, Issue 12, 2009, Pages

  Dover, Matthew R ^a   Evans, Corey J ^a   Western, Colin M ^b  

^a UNIVERSITY OF LEICESTER   (United Kingdom)

^b UNIVERSITY OF BRISTOL   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

ANHARMONIC VIBRATIONAL FREQUENCY; CENTRIFUGAL DISTORTION CONSTANTS; DISPERSED FLUORESCENCE SPECTROSCOPIES; ELECTRONIC TRANSITION; GROUND ELECTRONIC STATE; HIGH-VOLTAGE DISCHARGES; LASER INDUCED FLUORESCENCE; LASER INDUCED FLUORESCENCE SPECTROSCOPY; OUT-OF-PLANE BENDING; ROTATION ANGLES; ROTATIONAL RESOLUTION; SPECTROSCOPIC INVESTIGATIONS; VIBRATIONAL BANDS; WAGGING MODES;

CENTRIFUGATION; FLUORESCENCE SPECTROSCOPY; LASER PRODUCED PLASMAS; ROTATION;

FLUORESCENCE;

EID: 70349624430     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3224128     Document Type: Article

References (20)

1. C. J. Evans and M. R. Dover, J. Phys. Chem. A 1089-5639 113, 8533 (2009). 10.1021/jp902966y
2. M. Guelin, S. Muller, J. Cernicharo, A. J. Apponi, M. C. McCarthy, C. A. Gottlieb, and P. Thaddeus, Astron. Astrophys. 0004-6361 363, L9 (2000); R. Lucas, M. Guelin, C. Kahane, P. Audinos, and J. Cernicharo, Astrophys. Space Sci. 0004-640X 224, 293 (1995) 10.1007/BF00667860; M. E. Sanz, M. C. McCarthy, and P. Thaddeus, Astrophys. J. 0004-637X 577, L71 (2002). 10.1086/344083
3. R. N. Dixon and N. G. Wright, Chem. Phys. Lett. 0009-2614 117, 280 (1985) 10.1016/0009-2614(85)80221-9; G. Herzberg and R. D. Verma, Can. J. Phys. 0008-4204 42, 395 (1964); J. Billingsley, Can. J. Phys. 0008-4204 50, 531 (1972).
4. W. W. Harper and D. J. Clouthier, J. Chem. Phys. 0021-9606 106, 9461 (1997). 10.1063/1.473849
5. M. R. Dover and C. J. Evans, J. Phys. Chem. A 1089-5639 111, 13148 (2007). 10.1021/jp076289p
6. W. W. Duley and D. A. Williams, Interstellar Chemistry (Academic, London, 1984).
7. W. W. Harper and D. J. Clouthier, J. Chem. Phys. 0021-9606 108, 416 (1998) 10.1063/1.475403; B. S. Tackett, S. G. He, C. J. Evans, D. J. Clouthier, and R. H. Judge, J. Chem. Phys. 0021-9606 119, 2037 (2003). 10.1063/1.1584032
8. J. A. J. Fitzpatrick, O. V. Chekhlov, J. M. F. Elks, C. M. Western, and S. H. Ashworth, J. Chem. Phys. 0021-9606 115, 6920 (2001). 10.1063/1.1405121 (Pubitemid 33028819)
9. M. J. Frisch, G. W. Trucks, H. B. Schlegel, GAUSSIAN 03, Revision D.02, Gaussian Inc., Wallington, CT, 2004.
10. H. Nakatsuji, Chem. Phys. Lett. 0009-2614 67, 334 (1979) 10.1016/0009-2614(79)85173-8; H. Nakatsuji, Chem. Phys. Lett. 0009-2614 177, 331 (1991). 10.1016/0009-2614(91)85040-4
11. C. Møller and M. S. Plesset, Phys. Rev. 0096-8250 46, 618 (1934). 10.1103/PhysRev.46.618
12. See EPAPS supplementary material at http://dx.doi.org/10.1063/1.3224128 E-JCPSA6-131-023936 for additional data on this work.
13. J. K. G. Watson, in Vibrational Spectra and Structure: A Series of Advances, edited by, J. R. Durig, (Elsevier, Amsterdam, 1977), Vol. 6; H. M. Pickett, SPFIT, a linear least squares fitting program, 1990.
14. C. J. Cramer, Essentials of Computational Chemistry: Theories and Models, 2nd ed. (Wiley, Hoboken, 2004).
15. G. O. Neely, J. Mol. Spectrosc. 0022-2852 27, 177 (1968) 10.1016/0022-2852(68)90028-3; S. C. Ross, M. Niedenhoff, and K. M. T. Yamada, J. Mol. Spectrosc. 0022-2852 164, 432 (1994) 10.1006/jmsp.1994.1087; M. Niedenhoff, K. M. T. Yamada, G. Winnewisser, and S. C. Ross, J. Mol. Struct. 0022-2860 352-353, 423 (1995). 10.1016/0022-2860(94)08502-9
16. C. M. Western, PGOPHER, a program for simulating rotational structure, Version 5.2.343, University of Bristol, 2005, http://pgopher.chm.bris.ac.uk.
17. E. B. Wilson, P. C. Cross, and J. C. Decius, Molecular Vibrations: The Theory of Infrared and Raman Vibrational Spectra (McGraw-Hill, New York, 1955).
18. J. T. Hougen and J. K. G. Watson, Can. J. Phys. 0008-4204 43, 298 (1965).
19. D. F. Plusquellic, " User guide to the Jb95 spectral fitting program.," Version 2.05.1," National Institute of Standards and Technology, Gaithersburg, MD, 2002 (online).
20. M. H. Palmer and A. D. Nelson, J. Mol. Struct. 0022-2860 689, 161 (2004) 10.1016/j.molstruc.2003.11.008; I. Hargittai and I. C. Paul, in The Chemistry of Cyanates and Their Thio Derivatives, edited by, S. Patai, (Wiley, Chichester, 1977), Vol. 1, p. 69.