IR Data for Compound 42.

DOI: 10.14469/hpc/11510 Metadata

Created: 2022-10-24 17:54

Last modified: 2024-04-01 17:46

Author: Henry Rzepa

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

IR Data for Bis(ethanol) bis((4-(ethoxycarbonyl)-1-phenyl-1H-pyrazol-5-yl)oxy)manganese (42)

Files

FilenameSizeTypeDescription
42.png 82KB image/png Image representation
TM-VI-228_2022-01-21T15-46-06.pdf 63KB application/pdf IR Spectrum as PDF
42.cdxml 14KB chemical/x-cdxml Chemdraw connection table
42.mol 4KB chemical/x-mdl-molfile MDL Molfile
42.cdxml 17KB chemical/x-cdxml Chemdraw connection table, V2
42.png 45KB image/png Image representation, V2
42.mol 5KB chemical/x-mdl-molfile MDL Molfile, V2

Member of collection / collaboration

DOIDescription
10.14469/hpc/11396 Compound 42: bis((4-(ethoxycarbonyl)-1-phenyl-1H-pyrazol-5-yl)oxy)manganese

Subject Keywords

KeywordValue
IFD.IR IR Spectrum
inchi InChI=1S/2C12H12N2O3.2C2H6O.Mn/c2*1-2-17-12(16)10-8-13-14(11(10)15)9-6-4-3-5-7-9;2*1-2-3;/h2*3-8,15H,2H2,1H3;2*3H,2H2,1H3;/q;;;;+2/p-2
inchikey IKKKGPUIXXYGGF-UHFFFAOYSA-L
SMILES [H]O(CC)[Mn]12(OC3=C(C(OCC)=O1)C=NN3C4=CC=CC=C4)(OC5=C(C(OCC)=O2)C=NN5C6=CC=CC=C6)O([H])CC

Edit