Bis(3,4,5-trifluorophenyl)-borinic acid benzylamine-4'-phenylbutanoate

DOI: 10.14469/hpc/2757 Metadata

Created: 2017-07-23 09:34

Last modified: 2019-02-05 16:48

Author: Henry Rzepa

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

_database_code_depnum_ccdc_archive 1551616

Files

FilenameSizeTypeDescription
Bis(3,4,5-trifluorophenyl)-borinic_acid_benzylamine-4'-phenylbutanoate.cif 816KB chemical/x-cif CIF dataset, including thermal parameters and hkl indices.

Member of collection / collaboration

DOIDescription
10.14469/hpc/2248 A mechanistic insight into the boron-catalysed direct amidation reaction. Crystal structures

Subject Keywords

KeywordValue
inchi InChI=1S/C26H21BF2NO2.C18H10BF6NO2.C9H11.2C2H2.CF.3F.2H/c1-5-20(4)19-30-27(22(6-2)7-3,23-16-17-24(28)25(29)18-23)32-26(31)15-11-14-21-12-9-8-10-13-21;1-3-10(2)8-26-19(28-9-27,11-4-13(20)17(24)14(21)5-11)12-6-15(22)18(25)16(23)7-12;1-2-6-9-7-4-3-5-8-9;3*1-2;;;;;/h1,5-10,12-13,16,18H,11,14-15,19,30H2;1,3-7H,8,26H2;3-5,7-8H,1-2,6H2;2*1-2H;;;;;;/b20-5+;10-3+;;;;;;;;;
inchikey HJJRNHHRTDGOSD-DULATRPUSA-N

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