Primary crystal structure data for Compound 38. (m-O)-Di-[cyclopentadienyl-bis((4-(ethoxycarbonyl)-1-phenyl-1H-pyrazol-5-yl)oxy)zirconium]

DOI: 10.14469/hpc/11392 Metadata

Created: 2022-10-12 09:24

Last modified: 2024-06-27 18:00

Author: Henry Rzepa

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

Primary crystal structure data for (m-O)-Di-[cyclopentadienyl-bis((4-(ethoxycarbonyl)-1-phenyl-1H-pyrazol-5-yl)oxy)zirconium] (38)

Files

FilenameSizeTypeDescription
AB2157.cif 586KB chemical/x-cif CIF processed data
AB2157.7z 262MB application/x-7z-compressed g7z archive of primary crystal data
AB2157.tar.gz 273MB application/gzip gzip archive of primary crystal data
38.cdxml 23KB chemical/x-cdxml Chemdraw connection table
38.cdxml 24KB chemical/x-cdxml Chemdraw connection table V2
38.png 113KB image/png Image structure representation

Member of collection / collaboration

DOIDescription
10.14469/hpc/11375 Compound 38: (m-O)-Di-[cyclopentadienyl-bis((4-(ethoxycarbonyl)-1-phenyl-1H-pyrazol-5-yl)oxy)zirconium]

Associated DOIs

Current dataset ...DOIDescription
isReferencedBy 10.5517/ccdc.csd.cc2d6q6k CSD Entry: VIPKUE
References 10.5517/ccdc.csd.cc2d6q6k CSD Entry: VIPKUE

Subject Keywords

KeywordValue
IFD.XRAY Crystal structure
inchi InChI=1S/4C12H12N2O3.2C5H10.2CH3.O.2Zr/c4*1-2-17-12(16)10-8-13-14(11(10)15)9-6-4-3-5-7-9;2*1-2-4-5-3-1;;;;;/h4*3-8,15H,2H2,1H3;2*1-5H2;2*1H3;;;/q;;;;;;;;;2*+2/p-4
inchikey BMCOBKREHKLUDL-UHFFFAOYSA-J

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