Computational coordinates

DOI: 10.14469/hpc/3172 Metadata

Created: 2017-10-10 09:45

Last modified: 2019-02-05 16:48

Author: Clare Bakewell

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

Computational coordinates

Files

FilenameSizeTypeDescription
coordinates.xyz 139KB chemical/x-xyz xyz file

Member of collection / collaboration

DOIDescription
10.14469/hpc/3155 A Combined Experimental and Computational Study on the Reaction of Fluoroarenes with Mg–Mg, Mg–Zn, Mg–Al and Al–Zn Bonds

Subject Keywords

KeywordValue
inchi InChI=1S/2C29H41N2.2Mg/c2*1-18(2)24-13-11-14-25(19(3)4)28(24)30-22(9)17-23(10)31-29-26(20(5)6)15-12-16-27(29)21(7)8;;/h2*11-21H,1-10H3;;/q2*-2;2*+2
inchikey JAYGBGSONJVUIO-UHFFFAOYSA-N

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