11979705 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 78 15 15 15 15 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 3 3 3 4 4 4 5 5 5 6 6 7 7 8 8 9 9 10 10 11 11 12 12 13 13 14 14 15 15 16 16 17 17 18 18 19 19 20 20 21 21 22 22 23 23 24 24 25 25 26 26 27 27 28 28 29 29 30 30 31 31 32 32 33 33 34 34 35 35 36 36 37 37 38 38 39 39 40 40 41 41 42 42 43 43 44 44 45 45 46 46 47 47 48 48 49 49 50 50 51 51 52 52 53 53 54 54 55 55 56 56 57 57 58 58 59 59 60 60 61 61 62 62 63 63 64 64 65 65 66 67 68 69 70 71 72 73 74 75 76 77 6 7 8 9 10 11 12 13 14 15 16 17 18 30 19 31 20 32 21 33 22 34 23 35 24 36 25 37 26 38 27 39 28 40 29 41 42 78 43 79 44 80 45 81 46 82 47 83 48 84 49 85 50 86 51 87 52 88 53 89 54 90 55 91 56 92 57 93 58 94 59 95 60 96 61 97 62 98 63 99 64 100 65 101 66 102 67 103 68 104 69 105 70 106 71 107 72 108 73 109 74 110 75 111 76 112 77 113 66 114 67 115 68 116 69 117 70 118 71 119 72 120 73 121 74 122 75 123 76 124 77 125 126 127 128 129 130 131 132 133 134 135 136 137 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 11.155 3.135 11.405 3.135 11.405 3.135 4.001 2.269 11.405 12.2711 10.539 3.135 4.001 2.269 11.405 12.2711 10.539 4.001 4.001 1.403 12.2711 12.2711 9.673 4.001 4.001 1.403 12.2711 12.2711 9.673 2.269 4.8671 2.269 10.539 13.1371 10.539 2.269 4.8671 2.269 10.539 13.1371 10.539 4.001 4.8671 0.5369 12.2711 13.1371 8.807 4.001 4.8671 0.5369 12.2711 13.1371 8.807 2.269 5.7331 1.403 10.539 14.0031 9.673 2.269 5.7331 1.403 10.539 14.0031 9.673 3.135 5.7331 0.5369 11.405 14.0031 8.807 3.135 5.7331 0.5369 11.405 14.0031 8.807 4.538 3.4641 1.403 12.808 11.7341 9.673 4.538 3.4641 1.403 12.808 11.7341 9.673 1.732 4.8671 2.8059 10.0021 13.1371 11.0759 1.732 4.8671 2.8059 10.0021 13.1371 11.0759 4.538 4.8671 0 12.808 13.1371 8.27 4.538 4.8671 0 12.808 13.1371 8.27 1.732 6.27 1.403 10.0021 14.54 9.673 1.732 6.27 1.403 10.0021 14.54 9.673 3.135 6.27 0 11.405 14.54 8.27 3.135 6.27 0 11.405 14.54 8.27 0 4.87 6.12 13.11 14.36 3.87 5.37 5.37 5.12 6.62 6.62 12.11 13.61 13.61 13.36 14.86 14.86 3.37 6.37 4.87 4.62 7.62 6.12 11.61 14.61 13.11 12.86 15.86 14.36 3.37 4.87 6.37 4.62 6.12 7.62 11.61 13.11 14.61 12.86 14.36 15.86 2.37 6.87 5.37 3.62 8.12 6.62 10.61 15.11 13.61 11.86 16.36 14.86 2.37 5.37 6.87 3.62 6.62 8.12 10.61 13.61 15.11 11.86 14.86 16.36 1.87 6.37 6.37 3.12 7.62 7.62 10.11 14.61 14.61 11.36 15.86 15.86 3.68 6.68 4.25 4.93 7.93 5.5 11.92 14.92 12.49 13.17 16.17 13.74 3.68 4.25 6.68 4.93 5.5 7.93 11.92 12.49 14.92 13.17 13.74 16.17 2.06 7.49 5.06 3.31 8.74 6.31 10.3 15.73 13.3 11.55 16.98 14.55 2.06 5.06 7.49 3.31 6.31 8.74 10.3 13.3 15.73 11.55 14.55 16.98 1.25 6.68 6.68 2.5 7.93 7.93 9.49 14.92 14.92 10.74 16.17 16.17 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 6 6 7 7 8 8 9 9 10 10 11 11 12 12 13 13 14 14 15 15 16 16 17 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 18 30 19 31 20 32 21 33 22 34 23 35 24 36 25 37 26 38 27 39 28 40 29 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 66 67 68 69 70 71 72 73 74 75 76 77 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 202 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 12 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 00000371F07C00038000000000000004000000000000000000003060C18300000000000154000018080000000008008010003000800000208000204200000200002000000888000000880820228011108020002080000888070000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 platinum;triphenylphosphane IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 platinum;triphenylphosphine IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 platinum;triphenylphosphane IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 platinum;triphenylphosphane IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 platinum;triphenylphosphane IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 platinum;triphenylphosphine InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/4C18H15P.Pt/c4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;/h4*1-15H; InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 SYKXNRFLNZUGAJ-UHFFFAOYSA-N Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 1243.329344 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 C72H60P4Pt Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 1244.2 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Pt] SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Pt] Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 1243.329344 77 0 0 0 0 0 0 0 5 -1