Synonyms
SCHEMBL2189792;219143-92-7;(S,S)-N,N -Bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexanediaminochromium(III) chloride;
IUPAC Name
chromium;2,4-ditert-butyl-6-[[(1S,2S)-2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylideneamino]cyclohexyl]iminomethyl]phenol;chloride;
Molecular Weight
634.286g/mol
Molecular Formula
C36H54ClCrN2O2-;
Canonical SMILES
CC(C)(C)C1=CC(=C(C(=C1)C=NC2CCCCC2N=CC3=CC(=CC(=C3O)C(C)(C)C)C(C)(C)C)O)C(C)(C)C.[Cl-].[Cr];
InChI
InChI=1S/C36H54N2O2.ClH.Cr/c1-33(2,3)25-17-23(31(39)27(19-25)35(7,8)9)21-37-29-15-13-14-16-30(29)38-22-24-18-26(34(4,5)6)20-28(32(24)40)36(10,11)12;;/h17-22,29-30,39-40H,13-16H2,1-12H3;1H;/p-1/t29-,30-;;/m0../s1;
InChI Key
URIXSIRVKMNVQX-ARDORAJISA-M;
Covalently-Bonded Unit Count
3
Defined Atom Stereocenter Count
2
Monoisotopic Mass
633.328g/mol
Topological Polar Surface Area
65.2A^2