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fe h200n hpcd nrvs samples 57 fe  (Cambridge Isotope Laboratories)
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Cambridge Isotope Laboratories fe h200n hpcd nrvs samples 57 fe
A) NRVS data for <t>H200N-4NC-NO,</t> with peak energies given and peaks assigned by correlation to B. Note that there is a discontinuity at 337 cm−1 in A due to splicing together two data sets, where the higher energy data set used a longer count rate from 300 to 630 cm−1 in order to resolve the peak at 419 cm−1 above the noise level. B) Best DFT calculated spectrum for H200N-4NC-NO, with modes labeled as in D. C) DFT-optimized structure of H200N-4NC-NO, with important structural parameters given. Fe is shown in orange, amino acid carbons in green, substrate carbons in purple, nitrogens in blue, oxygens in red, and hydrogens in white. D) Schematic depictions of the normal modes that appear in the NRVS data and calculated spectrum.
Fe H200n Hpcd Nrvs Samples 57 Fe, supplied by Cambridge Isotope Laboratories, used in various techniques. Bioz Stars score: 86/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
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A) NRVS data for H200N-4NC-NO, with peak energies given and peaks assigned by correlation to B. Note that there is a discontinuity at 337 cm−1 in A due to splicing together two data sets, where the higher energy data set used a longer count rate from 300 to 630 cm−1 in order to resolve the peak at 419 cm−1 above the noise level. B) Best DFT calculated spectrum for H200N-4NC-NO, with modes labeled as in D. C) DFT-optimized structure of H200N-4NC-NO, with important structural parameters given. Fe is shown in orange, amino acid carbons in green, substrate carbons in purple, nitrogens in blue, oxygens in red, and hydrogens in white. D) Schematic depictions of the normal modes that appear in the NRVS data and calculated spectrum.

Journal: Journal of the American Chemical Society

Article Title: NRVS definition of O 2 intermediates in an extradiol dioxygenase: correlation to crystallography and reactivity

doi: 10.1021/jacs.8b06517

Figure Lengend Snippet: A) NRVS data for H200N-4NC-NO, with peak energies given and peaks assigned by correlation to B. Note that there is a discontinuity at 337 cm−1 in A due to splicing together two data sets, where the higher energy data set used a longer count rate from 300 to 630 cm−1 in order to resolve the peak at 419 cm−1 above the noise level. B) Best DFT calculated spectrum for H200N-4NC-NO, with modes labeled as in D. C) DFT-optimized structure of H200N-4NC-NO, with important structural parameters given. Fe is shown in orange, amino acid carbons in green, substrate carbons in purple, nitrogens in blue, oxygens in red, and hydrogens in white. D) Schematic depictions of the normal modes that appear in the NRVS data and calculated spectrum.

Article Snippet: Preparation of 57 Fe H200N HPCD NRVS samples 57 Fe (96.8 %) was purchased from Cambridge Isotopes.

Techniques: Labeling