4dq

DOI: 10.14469/hpc/4360 Metadata

Created: 2018-06-01 13:38

Last modified: 2019-02-05 16:48

Author: Henry Rzepa

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

Crystallographic data in CIF format + original image data collected from difractometer.

Files

FilenameSizeTypeDescription
4dq.cif 397KB chemical/x-cif Crystal data in CIF format
4dq.zip 262MB application/zip Full crystal data in diffractometer format
4dq.mnpub 0 chemical/x-mnpub Mestrenova signature file for 4dq.zip

Member of collection / collaboration

DOIDescription
10.14469/hpc/4356 Azide-alkene cycloaddition. Crystallographic data

Subject Keywords

KeywordValue
inchi InChI=1S/C19H10NO.C13H6N.C5H3.C2H5O2.C2H5.C2H3.2C2H2.CO.C.2O.11H/c1-2-3-9-18-19(16-7-5-4-6-8-16)20(18)17-12-10-15(14-21)11-13-17;1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13;1-3-5-4-2;1-2-4-3;5*1-2;;;;;;;;;;;;;;/h1-5,7,10-12,19H;1,3,5,7,9,11H;1,3,5H;2H2,1H3;1H2,2H3;1H,2H2;2*1-2H;;;;;;;;;;;;;;;/b;14-11+;;;;;;;;;;;;;;;;;;;;;/t9-,19-,20-;;;;;;;;;;;;;;;;;;;;;;/m1....................../s1
inchikey QRCIRDXPORWMHF-XUTSVRNTSA-N

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