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Low temperature matrix-isolation and solid state vibrational spectra of 5-chlorotetrazoleElectronic supplementary information (ESI) available: Calculated molecular geometries, rotational constants, energies and dipole moments. Definition of internal symmetry coordinates used in the normal mode analysis. Experimental spectrum of polycrystalline 5-chlorotetrazole and calculated spectrum for the 1H-tautomer. See http://www.rsc.org/suppdata/cp/b1/b111329c/

โœ Scribed by C. S. Bugalho, Susana; Serra, A. C.; Lapinski, Leszek; S. Cristiano, M. Lurdes; Fausto, Rui

Book ID
120380991
Publisher
Royal Society of Chemistry
Year
2002
Tongue
English
Weight
201 KB
Volume
4
Category
Article
ISSN
1463-9076

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๐Ÿ“œ SIMILAR VOLUMES

Vibrational spectrum and molecular struc
Vibrational spectrum and molecular structure of triphenylamine monomer: A combined matrix-isolation FTIR and theoretical studyElectronic supplementary information (ESI) available: Fig. S1 provides atom numbering and Table S1 optimized geometry parameters and rotational constants for the TPA molecule. Table S2 provides a list of calculated frequencies and descriptions for fully symmetrical (A1) vibrations in the TPA monomer. Figs. S2?S4 present changes in the TPA molecule geometry during potential energy scans with different symmetry restrictions.See http://www.rsc.org/suppdata/cp/b3/b306489a/
โœ Reva, Igor; Lapinski, Leszek; Chattopadhyay, Nitin; Fausto, Rui ๐Ÿ“‚ Article ๐Ÿ“… 2003 ๐Ÿ› Royal Society of Chemistry ๐ŸŒ English โš– 155 KB