DOI: 10.14469/hpc/2094 Metadata

Created: 2017-01-18 12:17

Last modified: 2019-02-05 16:48

Author: Alexandra Hicken

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

Optimised coordinates from calculations

Files

Filename	Size	Type	Description
IC_DFT_Coordinates.mol2	112KB	chemical/x-mol2

Member of collection / collaboration

DOI	Description
10.14469/hpc/2074	Reversible Coordination of Boron–, Aluminum–, Zinc–, Magnesium– and Calcium–Hydrogen bonds to bent {CuL2} fragments: Heavy Sigma-Complexes of the Lightest Coinage Metal

Subject Keywords

Keyword	Value
inchi	InChI=1S/C23H24F6N2.Cu/c1-12-7-14(3)20(15(4)8-12)30-18(22(24,25)26)11-19(23(27,28)29)31-21-16(5)9-13(2)10-17(21)6;/h7-10H,11H2,1-6H3;/q;+2/b30-18-,31-19-;
inchikey	KECSQBAKNCZVNH-GQJUHYNTSA-N

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