copper(I)](https://resource.alfa-chemistry.com/structure/920739-11-3.gif)
Synonyms
[1,3-Bis(2,6-diisopropylphenyl)imidazol-2-ylidene](1,3-diphenyl-1,3-propanedionato)copper(I);920739-11-3;
IUPAC Name
[1,3-Bis(2,6-diisopropylphenyl)imidazol-2-ylidene](1,3-diphenyl-1,3-pr...
Molecular Weight
676.4
Molecular Formula
C42H48CuN2O2
InChI
InChI=1S/C27H36N2.C15H12O2.Cu/c1-18(2)22-11-9-12-23(19(3)4)26(22)28-15-16-29(17-28)27-24(20(5)6)13-10-14-25(27)21(7)8;16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13;/h9-16,18-21H,1-8H3;1-11,16H;/b;14-11-;
InChI Key
QEXNUQSCWMWURE-CKWHXWLXSA-N
Purity
98%
Complexity
744
Covalently-Bonded Unit Count
3
Exact Mass
675.301176
H-Bond Acceptor
4
H-Bond Donor
1
Heavy Atom Count
47
Isomeric SMILES
CC(C)C1=C(C(=CC=C1)C(C)C)N2C=CN([C]2)C3=C(C=CC=C3C(C)C)C(C)C.C1=CC=C(C=C1)/C(=C/C(=O)C2=CC=CC=C2)/O.[Cu]
Monoisotopic Mass
675.301176
Rotatable Bond Count
9
Topological Polar Surface Area
43.8 Ų
Undefined Bond Stereocenter Count
1
