The rovibrational overtone spectrum of H13CNO up to 3600 cm-1:: A network of resonance systems

被引:13
作者
Albert, S
Albert, KK
Winnewisser, M
Winnewisser, BP
机构
[1] Univ Giessen, Inst Phys Chem, D-35392 Giessen, Germany
[2] Ohio No Univ, Dept Phys, Ada, OH 45810 USA
来源
BERICHTE DER BUNSEN-GESELLSCHAFT-PHYSICAL CHEMISTRY CHEMICAL PHYSICS | 1998年 / 102卷 / 10期
关键词
light; absorption; molecular dynamics; molecular interactions; quantum mechanics; spectroscopy; infrared;
D O I
10.1002/bbpc.199800012
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The infrared spectrum of fulminic acid, (HCNO)-C-13, has been analyzed in the range 700-3600 cm(-1). More than 90 new vibrational levels have been identified. Power series coefficients of these levels are given. Every vibrational level and its rotational levels are locally or globally perturbed. It was possible to classify most of the interactions into a grand network of Coriolis- and/or Fermi-type resonance systems, similar to that described for the parent species (HCNO)-C-12, by using the previously known basic resonance systems 00010/00002 and 00100/00004. In addition, as for (HCNO)-C-12, another basic resonance for (HCNO)-C-13 was identified as 01000/00111, leading to the system 00015/01000/00103/(00111), corresponding to a resonance involving the same states in the parent species. As a consequence of the interactions, many so-called "resonance-enbanced" rovibrational subbands have been assigned. The identification and partial analysis of the resonance systems have been carried out, first with the help of different representations of reduced term values and second, by determining the J-value separation between e and f crossing points. The five main resonance systems will be discussed in this paper.
引用
收藏
页码:1428 / 1448
页数:21
相关论文
共 24 条
[1]   Networks of anharmonic resonance systems in the rovibrational overtone spectra of the quasilinear molecule HCNO [J].
Albert, S ;
Winnewisser, M ;
Winnewisser, BP .
BERICHTE DER BUNSEN-GESELLSCHAFT-PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 1996, 100 (11) :1876-1898
[2]   The nu(1), nu(2), 2 nu(3), nu(2)+nu(3) band systems and the overtone region of HCNO above 4000 cm(-1): A network of resonance systems [J].
Albert, S ;
Winnewisser, M ;
Winnewisser, BP .
BERICHTE DER BUNSEN-GESELLSCHAFT-PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 1997, 101 (08) :1165-1186
[3]  
ALBERT S, 1995, THESIS J LIEBIG U GI
[4]  
ALBERT S, 1997, MICROCHIM ACTA, V14, P79
[5]   HCNO AS A SEMIRIGID BENDER [J].
BUNKER, PR ;
LANDSBERG, BM ;
WINNEWISSER, BP .
JOURNAL OF MOLECULAR SPECTROSCOPY, 1979, 74 (01) :9-25
[6]   FOURIER-TRANSFORM SPECTRA OF THE 3300 CM-1 BANDS OF HCN [J].
CHOE, JI ;
TIPTON, T ;
KUKOLICH, SG .
JOURNAL OF MOLECULAR SPECTROSCOPY, 1986, 117 (02) :292-307
[7]   INFRARED BANDS OF HCNO MOLECULE [J].
FERRETTI, EL ;
RAO, KN .
JOURNAL OF MOLECULAR SPECTROSCOPY, 1974, 51 (01) :97-106
[8]  
GUELACHVILI G, 1986, HDB INFRARED STANDAR
[9]   DOES FULMINIC ACID HAVE A BENT EQUILIBRIUM STRUCTURE [J].
HANDY, NC ;
MURRAY, CW ;
AMOS, RD .
PHILOSOPHICAL MAGAZINE B-PHYSICS OF CONDENSED MATTER STATISTICAL MECHANICS ELECTRONIC OPTICAL AND MAGNETIC PROPERTIES, 1994, 69 (05) :755-762
[10]   HCNO AS A SEMIRIGID BENDER - THE DEGENERATE NU-4-STATE [J].
JENSEN, P .
JOURNAL OF MOLECULAR SPECTROSCOPY, 1983, 101 (02) :422-439