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Tetrakis[(S)-(+)-[(1S)-1-(4-bromophenyl)-2,2-diphenylcyclopropanecarboxylato]dirhodium(II) Rh2(S-BTPCP)4

Catalog Number ACM1345974631-1
CAS 1345974-63-1
Synonyms (1S)-1-(4-Bromophenyl)-2,2-diphenylcyclopropane-1-carboxylic acid;rhodium
IUPAC Name (1S)-1-(4-bromophenyl)-2,2-diphenylcyclopropane-1-carboxylic acid;rhodium;
Molecular Weight 1774.87
Molecular Formula C88H64Br4O8Rh2
Canonical SMILES C1C(C1(C2=CC=C(C=C2)Br)C(=O)[O-])(C3=CC=CC=C3)C4=CC=CC=C4.C1C(C1(C2=CC=C(C=C2)Br)C(=O)[O-])(C3=CC=CC=C3)C4=CC=CC=C4.C1C(C1(C2=CC=C(C=C2)Br)C(=O)[O-])(C3=CC=CC=C3)C4=CC=CC=C4.C1C(C1(C2=CC=C(C=C2)Br)C(=O)[O-])(C3=CC=CC=C3)C4=CC=CC=C4.[Rh+2].[Rh+2]
InChI InChI=1S/4C22H17BrO2.2Rh/c4*23-19-13-11-18(12-14-19)22(20(24)25)15-21(22,16-7-3-1-4-8-16)17-9-5-2-6-10-17;/h4*1-14H,15H2,(H,24,25);/q;2*+2/p-4/t4*22-;/m1/s1
InChI Key AUKMNKVXIVVWIG-MSZWWGBCSA-J
Purity 98%+
Appearance Green solid
Complexity 2220
Covalently-Bonded Unit Count 6
Defined Atom Stereocenter Count 4
Exact Mass 1773.94036
Heavy Atom Count 102
Hydrogen Bond Acceptor Count 8
Hydrogen Bond Donor Count 0
Isomeric SMILES C1[C@@](C1(C2=CC=CC=C2)C3=CC=CC=C3)(C4=CC=C(C=C4)Br)C(=O)[O-].C1[C@@](C1(C2=CC=CC=C2)C3=CC=CC=C3)(C4=CC=C(C=C4)Br)C(=O)[O-].C1[C@@](C1(C2=CC=CC=C2)C3=CC=CC=C3)(C4=CC=C(C=C4)Br)C(=O)[O-].C1[C@@](C1(C2=CC=CC=C2)C3=CC=CC=C3)(C4=CC=C(C=C4)Br)C(=O)[O-].[Rh+2].[Rh+2]
Monoisotopic Mass 1769.94446
Rotatable Bond Count 16
Topological Polar Surface Area 161 Ų

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