IR data for Compound 53.

DOI: 10.14469/hpc/11496 Metadata

Created: 2022-10-24 15:13

Last modified: 2024-06-25 08:48

Author: Henry Rzepa

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

IR data for Bis(ethanol) bis((4-(ethoxycarbonyl)-1-(4-methoxybenzyl)-1H-pyrazol-5-yl)oxy)copper (53)

Files

FilenameSizeTypeDescription
TM-VI-192_2021-12-05T18-25-32.pdf 62KB application/pdf IR Spectrum as PDF
53.png 66KB image/png Image representation of sample 53
53.cdxml 19KB chemical/x-cdxml Chemdraw connection table
53.mol 5KB chemical/x-mdl-molfile MDL Molfile
53.cdxml 19KB chemical/x-cdxml Chemdraw connection table v2
53.png 41KB image/png Image representation of sample v2
53.mol 3KB chemical/x-mdl-molfile MDL Molfile v2

Member of collection / collaboration

DOIDescription
10.14469/hpc/11400 Compound 53: Bis(ethanol) bis((4-(ethoxycarbonyl)-1-(4-methoxybenzyl)-1H-pyrazol-5-yl)oxy)copper

Subject Keywords

KeywordValue
IFD.IR IR Spectrum
inchi InChI=1S/2C14H16N2O4.2C2H6O.Cu/c2*1-3-20-14(18)12-8-15-16(13(12)17)9-10-4-6-11(19-2)7-5-10;2*1-2-3;/h2*4-8,17H,3,9H2,1-2H3;2*3H,2H2,1H3;/q;;;;+2/p-2
inchikey CEUCFEACXCNTTA-UHFFFAOYSA-L
SMILES CCO([H])[Cu]12(OC3=C(C(OCC)=O2)C=NN3CC4=CC=C(OC)C=C4)(O([H])CC)O=C(OCC)C(C=N5)=C(O1)N5CC6=CC=C(OC)C=C6

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