2 3 7 8 12 13 17 18-OCTAETHYL-21H 23H-(14409-63-3) ESR
Molecular FormulaC36H44CuN4
Molecular Weight596.318
InChIInChI=1S/C36H44N4.Cu/c1-9-21-22(10-2)30-18-32-25(13-5)26(14-6)34(39-32)20-36-28(16-8)27(15-7)35(40-36)19-33-24(12-4)23(11-3)31(38-33)17-29(21)37-30;/h17-20H,9-16H2,1-8H3;/q-2;+2/b29-17-,30-18-,31-17-,32-18-,33-19-,34-20-,35-19-,36-20-;
InChIKey WYWUPEFEFRBNGN-XTPDIVBZSA-N
SmilesN12[Cu]N3C4C=C5C(CC)=C(CC)C(=N5)C=C1C(CC)=C(CC)C2=CC1=NC(C(CC)=C1CC)=CC3=C(C=4CC)CC |c:15,25,36,t:4|