70076 1 2 3 4 53 17 17 17 1 1 1 2 3 4 1 1 1 1 5 255 1 2 3 4 3 3 2 4 -0.5 0.5 -0.5 -0.5 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 8 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 0 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 00000371000000000602000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 trichloro-lambda3-iodane IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 trichloro-lambda3-iodane IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 trichloro-&lambda;<SUP>3</SUP>-iodane IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 trichloro-lambda3-iodane IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 tris(chloranyl)-lambda3-iodane IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 trichloro-lambda3-iodane InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/Cl3I/c1-4(2)3 InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 PAWIVBWALDNUJP-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.10.14 3.3 Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 231.81103 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 Cl3I Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 233.26 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 ClI(Cl)Cl SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 ClI(Cl)Cl 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 2021.10.14 231.81103 4 0 0 0 0 0 0 0 1 -1